Curator Name UniProt ID NCBI Gene ID Gene Name Species Name Taxonomy ID Data Type Data Value Value Unit ChEBI Chemical Term A ChEBI Chemical ID A ChEBI Chemical Term B ChEBI Chemical ID B Secondary Source IDs Secondary Source Notes Reviewed (Y/N) Use (Y/N) Evidence Code Primary Source Secondary Source PENTACON Notes Gene Set Secondary Source Version Date Secondary Source Version PENTACON Annotation No Katie P12821 1636 ACE Homo sapiens 9606 Comment/biophysicochemical properties/KM 2.51 mM for Hip-His-Leu 2.51 mM Hip-His-Leu CHEBI:NEW_161404 Y Y ECO:0000006 PubMed:11076943 PubMed:12542396 UniProtKB No ChEBI term BP, DGA, AAE 4/3/2013 172 2200002612 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/Km 249 uM for phenylpyruvate 249 uM keto-phenylpyruvate CHEBI:18005 Y Y ECO:0000269 PubMed:11439086 UniProtKB DGA, AAE 9/3/2014 174 2200002681 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/Km 168 uM for p-hydroxyphenylpyruvate 168 uM 3-(4-hydroxyphenyl)pyruvate CHEBI:36242 Y Y UniProtKB DGA, AAE 9/3/2014 174 2200002682 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/Vmax 2113 umol/min/mg enzyme toward phenylpyruvate 2113 umol/min/mg keto-phenylpyruvate CHEBI:18005 Y Y UniProtKB DGA, AAE 9/3/2014 174 2200002683 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/Vmax 524 umol/min/mg enzyme toward p-hydroxyphenylpyruvate 524 umol/min/mg 3-(4-hydroxyphenyl)pyruvate CHEBI:36242 Y Y UniProtKB DGA, AAE 9/3/2014 174 2200002684 curatus Q9NYA1 8877 SPHK1 Homo sapiens 9606 Comment/biophysicochemical properties/Km 14 uM for sphingosine 14 uM sphingosine CHEBI:16393 Y Y ECO:0000006 PubMed:10947957 UniProtKB AAE 9/3/2014 126 2200002685 curatus Q9NYA1 8877 SPHK1 Homo sapiens 9606 Comment/biophysicochemical properties/Km #16# 0.0156 {sphingosine} <60> 0.0156 mM sphingosine CHEBI:16393 2.7.1.91 Y Y ECO:0000006 Pubmed:16584625 BRENDA <60> Taha, T.A.; Hannun, Y.A.; Obeid, L.M.: Sphingosine kinase: biochemical and cellular regulation and role in disease. J. Biochem. Mol. Biol. (2006) 39, 113-131. {Pubmed:16584625} AAE 12/7/2011 1111 2200002695 curatus Q9NYA1 8877 SPHK1 Homo sapiens 9606 Comment/biophysicochemical properties/Km #16,17# 0.016 {sphingosine} (#16,17# pH 7.4, 30°C, recombinant isozyme SPHK1 <37>) <37> 0.0167 mM sphingosine CHEBI:16393 2.7.1.91 #16,17# pH 7.4, 30°C, recombinant isozyme SPHK1 <37> Y Y ECO:0000006 Pubmed:13129923 BRENDA <37> Billich, A.; Bornancin, F.; Devay, P.; Mechtcheriakova, D.; Urtz, N.; Baumruker, T.: Phosphorylation of the immunomodulatory drug FTY720 by sphingosine kinases. J. Biol. Chem. (2003) 278, 47408-47415. {Pubmed:13129923} AAE 12/7/2011 1111 2200002698 curatus Q9NYA1 8877 SPHK1 Homo sapiens 9606 Comment/biophysicochemical properties/Km #16,17# 0.785 {FTY720} (#16,17# about, pH 7.4, 30°C, recombinant isozyme SPHK1 <37>) <37> 0.785 mM fingolimod CHEBI:63115 2.7.1.91 #16,17# about, pH 7.4, 30°C, recombinant isozyme SPHK1 <37> Y Y ECO:0000006 Pubmed:13129923 BRENDA <37> Billich, A.; Bornancin, F.; Devay, P.; Mechtcheriakova, D.; Urtz, N.; Baumruker, T.: Phosphorylation of the immunomodulatory drug FTY720 by sphingosine kinases. J. Biol. Chem. (2003) 278, 47408-47415. {Pubmed:13129923} AAE 12/7/2011 1111 2200002699 curatus P21917 1815 DRD4 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 7; Ki: 1.0 nM; Dopamine D4 receptor; 1 nM Isoindoline, 7 CHEBI:NEW_161476 84440 Y Y ECO:0000006 PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002700 curatus P21917 1815 DRD4 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 8; Ki: 0.5 nM; Dopamine D4 receptor; 0.5 nM Isoindoline, 8 CHEBI:NEW_161477 84441 Y Y ECO:0000006 PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002701 curatus P21917 1815 DRD4 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 9; Ki: 35.4 nM; Dopamine D4 receptor; 35.4 nM Isoindoline, 9 CHEBI:NEW_161478 84442 Y Y ECO:0000006 PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002702 curatus P21917 1815 DRD4 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 10; Ki: 1.2 nM; Dopamine D4 receptor; 1.2 nM Isoindoline, 10 CHEBI:NEW_161479 84443 Y Y ECO:0000006 PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002703 curatus P21917 1815 DRD4 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 11; Ki: 35.9 nM; Dopamine D4 receptor; 35.9 nM Isoindoline, 11 CHEBI:NEW_161480 84444 Y Y ECO:0000006 PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002704 curatus P21917 1815 DRD4 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 12; Ki: 0.5 nM; Dopamine D4 receptor; 0.5 nM Isoindoline, 12 CHEBI:NEW_161481 84445 Y Y ECO:0000006 PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002705 curatus P21917 1815 DRD4 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 13; Ki: 1.2 nM; Dopamine D4 receptor; 1.2 nM Isoindoline, 13 CHEBI:NEW_161482 84446 Y Y ECO:0000006 PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002706 curatus P21917 1815 DRD4 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 14; Ki: 23.0 nM; Dopamine D4 receptor; 23 nM Isoindoline, 14 CHEBI:NEW_161483 84447 Y Y ECO:0000006 PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002707 curatus P21917 1815 DRD4 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 15; Ki: 4.5 nM; Dopamine D4 receptor; 4.5 nM Isoindoline, 15 CHEBI:NEW_161484 84448 Y Y ECO:0000006 PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002708 curatus P21917 1815 DRD4 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 16; Ki: 3.7 nM; Dopamine D4 receptor; 3.7 nM Isoindoline, 16 CHEBI:NEW_161485 84449 Y Y ECO:0000006 PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002709 curatus P21917 1815 DRD4 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 17; Ki: 19.1 nM; Dopamine D4 receptor; 19.1 nM Isoindoline, 17 CHEBI:NEW_161486 84450 Y Y ECO:0000006 PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002710 curatus P21917 1815 DRD4 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 18; Ki: 0.6 nM; Dopamine D4 receptor; 0.6 nM Isoindoline, 18 CHEBI:NEW_161487 84451 Y Y ECO:0000006 PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002711 curatus P21917 1815 DRD4 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 19; Ki: 120.0 nM; Dopamine D4 receptor; 120 nM Isoindoline, 19 CHEBI:NEW_161488 84452 Y Y ECO:0000006 PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002712 curatus P21917 1815 DRD4 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 20; Ki: 1.4 nM; Dopamine D4 receptor; 1.4 nM Isoindoline, 20 CHEBI:NEW_161489 84453 Y Y ECO:0000006 PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002713 curatus P21917 1815 DRD4 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 21; Ki: 583.0 nM; Dopamine D4 receptor; 583 nM Isoindoline, 21 CHEBI:NEW_161490 84454 Y Y ECO:0000006 PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002714 curatus P21917 1815 DRD4 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 22; Ki: 727.0 nM; Dopamine D4 receptor; 727 nM Isoindoline, 22 CHEBI:NEW_161491 84455 Y Y ECO:0000006 PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002715 curatus P21917 1815 DRD4 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 23; Ki: 5.3 nM; Dopamine D4 receptor; 5.3 nM Isoindoline, 23 CHEBI:NEW_161492 84456 Y Y ECO:0000006 PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002716 curatus P21917 1815 DRD4 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 24; Ki: 24.3 nM; Dopamine D4 receptor; 24.3 nM Isoindoline, 24 CHEBI:NEW_161493 84457 Y Y ECO:0000006 PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002717 curatus P21917 1815 DRD4 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 26; Ki: 3.6 nM; Dopamine D4 receptor; 3.6 nM Isoindoline, 26 CHEBI:NEW_161495 84459 Y Y ECO:0000006 PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002719 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 7; Ki: 496.0 nM; Dopamine D2 receptor; 496 nM Isoindoline, 7 CHEBI:NEW_161476 84440 Y Y PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002720 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 8; Ki: 134.0 nM; Dopamine D2 receptor; 134 nM Isoindoline, 8 CHEBI:NEW_161477 84441 Y Y PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002721 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 9; Ki: 777.0 nM; Dopamine D2 receptor; 777 nM Isoindoline, 9 CHEBI:NEW_161478 84442 Y Y PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002722 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 10; Ki: 100.0 nM; Dopamine D2 receptor; 100 nM Isoindoline, 10 CHEBI:NEW_161479 84443 Y Y PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002723 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 11; Ki: 250.0 nM; Dopamine D2 receptor; 250 nM Isoindoline, 11 CHEBI:NEW_161480 84444 Y Y PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002724 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 12; Ki: 55.9 nM; Dopamine D2 receptor; 55.9 nM Isoindoline, 12 CHEBI:NEW_161481 84445 Y Y PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002725 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 13; Ki: 120.0 nM; Dopamine D2 receptor; 120 nM Isoindoline, 13 CHEBI:NEW_161482 84446 Y Y PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002726 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 14; Ki: 302.0 nM; Dopamine D2 receptor; 302 nM Isoindoline, 14 CHEBI:NEW_161483 84447 Y Y PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002727 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 15; Ki: 188.0 nM; Dopamine D2 receptor; 188 nM Isoindoline, 15 CHEBI:NEW_161484 84448 Y Y PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002728 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 16; Ki: 185.0 nM; Dopamine D2 receptor; 185 nM Isoindoline, 16 CHEBI:NEW_161485 84449 Y Y PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002729 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 17; Ki: 501.0 nM; Dopamine D2 receptor; 501 nM Isoindoline, 17 CHEBI:NEW_161486 84450 Y Y PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002730 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 18; Ki: 392.0 nM; Dopamine D2 receptor; 392 nM Isoindoline, 18 CHEBI:NEW_161487 84451 Y Y PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002731 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 19; Ki: 3527.0 nM; Dopamine D2 receptor; 3527 nM Isoindoline, 19 CHEBI:NEW_161488 84452 Y Y PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002732 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 20; Ki: 203.0 nM; Dopamine D2 receptor; 203 nM Isoindoline, 20 CHEBI:NEW_161489 84453 Y Y PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002733 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 23; Ki: 341.0 nM; Dopamine D2 receptor; 341 nM Isoindoline, 23 CHEBI:NEW_161492 84456 Y Y PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002734 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 24; Ki: 6912.0 nM; Dopamine D2 receptor; 6912 nM Isoindoline, 24 CHEBI:NEW_161493 84457 Y Y PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002735 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Isoindoline, 26; Ki: 120.0 nM; Dopamine D2 receptor; 120 nM Isoindoline, 26 CHEBI:NEW_161495 84459 Y Y PubMed:12362366 BindingDB DGA, AAE 9/1/2014 0 2200002737 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Piperidin-1-ium analog, 2; Ki: 3100.0 nM; Dopamine D3 Receptor; 3100 nM Piperidin-1-ium analog, 2 CHEBI:NEW_161496 86550 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002738 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 3; Ki: 1600.0 nM; Dopamine D3 Receptor; 1600 nM Azanium analog, 3 CHEBI:NEW_161497 86551 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002739 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Piperidin-1-ium analog, 4; Ki: 200.0 nM; Dopamine D3 Receptor; 200 nM Piperidin-1-ium analog, 4 CHEBI:NEW_161498 86552 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002740 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Piperidin-1-ium analog, 5; Ki: 1800.0 nM; Dopamine D3 Receptor; 1800 nM Piperidin-1-ium analog, 5 CHEBI:NEW_161499 86553 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002741 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 6; Ki: 1300.0 nM; Dopamine D3 Receptor; 1300 nM Azanium analog, 6 CHEBI:NEW_161500 86554 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002742 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Piperazin-1-ium analog, 7; Ki: 500.0 nM; Dopamine D3 Receptor; 500 nM Piperazin-1-ium analog, 7 CHEBI:NEW_161501 86555 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002743 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 28; Ki: 300.0 nM; Dopamine D3 Receptor; 300 nM Azanium analog, 28 CHEBI:NEW_161502 86556 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002744 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 29; Ki: 2200.0 nM; Dopamine D3 Receptor; 2200 nM Azanium analog, 29 CHEBI:NEW_161503 86557 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002745 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Piperidin-1-ium analog, 30; Ki: 300.0 nM; Dopamine D3 Receptor; 300 nM Piperidin-1-ium analog, 30 CHEBI:NEW_161504 86558 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002746 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 31; Ki: 1600.0 nM; Dopamine D3 Receptor; 1600 nM Azanium analog, 31 CHEBI:NEW_161505 86559 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002747 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 32; Ki: 3000.0 nM; Dopamine D3 Receptor; 3000 nM Azanium analog, 32 CHEBI:NEW_161506 86560 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002748 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Piperidin-1-ium analog, 2; Ki: 1300.0 nM; Dopamine D2 Receptor; 1300 nM Piperidin-1-ium analog, 2 CHEBI:NEW_161496 86550 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB DGA, AAE 9/1/2014 0 2200002749 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Piperidin-1-ium analog, 4; Ki: 400.0 nM; Dopamine D2 Receptor; 400 nM Piperidin-1-ium analog, 4 CHEBI:NEW_161498 86552 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB DGA, AAE 9/1/2014 0 2200002751 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Piperidin-1-ium analog, 5; Ki: 400.0 nM; Dopamine D2 Receptor; 400 nM Piperidin-1-ium analog, 5 CHEBI:NEW_161499 86553 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB DGA, AAE 9/1/2014 0 2200002752 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 6; Ki: 4500.0 nM; Dopamine D2 Receptor; 4500 nM Azanium analog, 6 CHEBI:NEW_161500 86554 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB DGA, AAE 9/1/2014 0 2200002753 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 28; Ki: 900.0 nM; Dopamine D2 Receptor; 900 nM Azanium analog, 28 CHEBI:NEW_161502 86556 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB DGA, AAE 9/1/2014 0 2200002755 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 29; Ki: 3900.0 nM; Dopamine D2 Receptor; 3900 nM Azanium analog, 29 CHEBI:NEW_161503 86557 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB DGA, AAE 9/1/2014 0 2200002756 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 32; Ki: 3800.0 nM; Dopamine D2 Receptor; 3800 nM Azanium analog, 32 CHEBI:NEW_161506 86560 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB DGA, AAE 9/1/2014 0 2200002759 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 53; Ki: 200.0 nM; Dopamine D3 receptor; 200 nM Azanium analog, 53 CHEBI:NEW_161507 86561 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002760 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 54; Ki: 200.0 nM; Dopamine D3 receptor; 200 nM Azanium analog, 54 CHEBI:NEW_161508 86562 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002761 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 55; Ki: 200.0 nM; Dopamine D3 receptor; 200 nM Azanium analog, 55 CHEBI:NEW_161509 86563 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002762 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 56; Ki: 80.0 nM; Dopamine D3 receptor; 80 nM Azanium analog, 56 CHEBI:NEW_161510 86564 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002763 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 57; Ki: 300.0 nM; Dopamine D3 receptor; 300 nM Azanium analog, 57 CHEBI:NEW_161511 86565 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002764 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 58; Ki: 300.0 nM; Dopamine D3 receptor; 300 nM Azanium analog, 58 CHEBI:NEW_161512 86566 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002765 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 59; Ki: 300.0 nM; Dopamine D3 receptor; 300 nM Azanium analog, 59 CHEBI:NEW_161513 86567 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002766 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 60; Ki: 100.0 nM; Dopamine D3 receptor; 100 nM Azanium analog, 60 CHEBI:NEW_161514 86568 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002767 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 61; Ki: 100.0 nM; Dopamine D3 receptor; 100 nM Azanium analog, 61 CHEBI:NEW_161515 86569 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002768 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 62; Ki: 100.0 nM; Dopamine D3 receptor; 100 nM Azanium analog, 62 CHEBI:NEW_161516 86570 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002769 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 63; Ki: 500.0 nM; Dopamine D3 receptor; 500 nM Azanium analog, 63 CHEBI:NEW_161517 86571 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002770 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 53; Ki: 500.0 nM; Dopamine D2 receptor; 500 nM Azanium analog, 53 CHEBI:NEW_161507 86561 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB DGA, AAE 9/1/2014 0 2200002771 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 54; Ki: 200.0 nM; Dopamine D2 receptor; 200 nM Azanium analog, 54 CHEBI:NEW_161508 86562 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB DGA, AAE 9/1/2014 0 2200002772 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 55; Ki: 200.0 nM; Dopamine D2 receptor; 200 nM Azanium analog, 55 CHEBI:NEW_161509 86563 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB DGA, AAE 9/1/2014 0 2200002773 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 56; Ki: 300.0 nM; Dopamine D2 receptor; 300 nM Azanium analog, 56 CHEBI:NEW_161510 86564 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB DGA, AAE 9/1/2014 0 2200002774 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 57; Ki: 2600.0 nM; Dopamine D2 receptor; 2600 nM Azanium analog, 57 CHEBI:NEW_161511 86565 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB DGA, AAE 9/1/2014 0 2200002775 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 58; Ki: 800.0 nM; Dopamine D2 receptor; 800 nM Azanium analog, 58 CHEBI:NEW_161512 86566 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB DGA, AAE 9/1/2014 0 2200002776 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 59; Ki: 1200.0 nM; Dopamine D2 receptor; 1200 nM Azanium analog, 59 CHEBI:NEW_161513 86567 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB DGA, AAE 9/1/2014 0 2200002777 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 60; Ki: 600.0 nM; Dopamine D2 receptor; 600 nM Azanium analog, 60 CHEBI:NEW_161514 86568 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB DGA, AAE 9/1/2014 0 2200002778 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 61; Ki: 200.0 nM; Dopamine D2 receptor; 200 nM Azanium analog, 61 CHEBI:NEW_161515 86569 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB DGA, AAE 9/1/2014 0 2200002779 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 62; Ki: 600.0 nM; Dopamine D2 receptor; 600 nM Azanium analog, 62 CHEBI:NEW_161516 86570 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB DGA, AAE 9/1/2014 0 2200002780 curatus P14416 1813 DRD2 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Azanium analog, 63; Ki: 1700.0 nM; Dopamine D2 receptor; 1700 nM Azanium analog, 63 CHEBI:NEW_161517 86571 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB DGA, AAE 9/1/2014 0 2200002781 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki ZINC 118327, 8; Ki: >10000 nM; Dopamine D3 Receptor; 10000 nM ZINC 118327, 8 CHEBI:NEW_161521 86572 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002785 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki ZINC 19294224, 9; Ki: 9461.0 nM; Dopamine D3 Receptor; 9461 nM ZINC 19294224, 9 CHEBI:NEW_161522 86573 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002786 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki ZINC 30900826, 10; Ki: 10000.0 nM; Dopamine D3 Receptor; 10000 nM ZINC 30900826, 10 CHEBI:NEW_161523 86574 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002787 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki ZINC 39217391, 11; Ki: 9282.5 nM; Dopamine D3 Receptor; 9282.5 nM ZINC 39217391, 11 CHEBI:NEW_161524 86575 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002788 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki ZINC 17173082, 12; Ki: 9827.0 nM; Dopamine D3 Receptor; 9827 nM ZINC 17173082, 12 CHEBI:NEW_161518 86576 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002789 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki ZINC 27406499, 25; Ki: >10000 nM; Dopamine D3 Receptor; 10000 nM ZINC 27406499, 25 CHEBI:NEW_161525 86577 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002790 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki ZINC 42228310, 26; Ki: 9306.0 nM; Dopamine D3 Receptor; 9306 nM ZINC 42228310, 26 CHEBI:NEW_161526 86578 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002791 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki ZINC 42123507, 27; Ki: >10000 nM; Dopamine D3 Receptor; 10000 nM ZINC 42123507, 27 CHEBI:NEW_161527 86579 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002792 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki ZINC 48057418, 45; Ki: 7213.0 nM; Dopamine D3 Receptor; 7213 nM ZINC 48057418, 45 CHEBI:NEW_161528 86580 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002793 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki ZINC 42157198, 46; Ki: 10000.0 nM; Dopamine D3 Receptor; 10000 nM ZINC 42157198, 46 CHEBI:NEW_161529 86581 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002794 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki ZINC 29218552, 47; Ki: 10000.0 nM; Dopamine D3 Receptor; 10000 nM ZINC 29218552, 47 CHEBI:NEW_161530 86582 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002795 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki ZINC 49944321, 48; Ki: 7771.0 nM; Dopamine D3 Receptor; 7771 nM ZINC 49944321, 48 CHEBI:NEW_161531 86583 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002796 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki ZINC 51423503, 49; Ki: 8736.0 nM; Dopamine D3 Receptor; 8736 nM ZINC 51423503, 49 CHEBI:NEW_161532 86584 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002797 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki ZINC 46272073, 50; Ki: 10000.0 nM; Dopamine D3 Receptor; 10000 nM ZINC 46272073, 50 CHEBI:NEW_161533 86585 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002798 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki ZINC 32799890, 51; Ki: 10000.0 nM; Dopamine D3 Receptor; 10000 nM ZINC 32799890, 51 CHEBI:NEW_161534 86586 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002799 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki ZINC 41903371, 52; Ki: 10000.0 nM; Dopamine D3 Receptor; 10000 nM ZINC 41903371, 52 CHEBI:NEW_161535 86587 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002800 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki ZINC 4942963, 64; Ki: 6805.0 nM; Dopamine D3 Receptor; 6805 nM ZINC 4942963, 64 CHEBI:NEW_161536 86588 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002801 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki ZINC 4942833, 65; Ki: 8672.0 nM; Dopamine D3 Receptor; 8672 nM ZINC 4942833, 65 CHEBI:NEW_161519 86589 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002802 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki ZINC 6743145, 66; Ki: 5456.0 nM; Dopamine D3 Receptor; 5456 nM ZINC 6743145, 66 CHEBI:NEW_161537 86590 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002803 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki ZINC 529108, 67; Ki: 9578.0 nM; Dopamine D3 Receptor; 9578 nM ZINC 529108, 67 CHEBI:NEW_161538 86591 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002804 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki ZINC 4999756, 68; Ki: 2744.0 nM; Dopamine D3 Receptor; 2744 nM ZINC 4999756, 68 CHEBI:NEW_161539 86592 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002805 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki ZINC 10436232, 69; Ki: 8886.0 nM; Dopamine D3 Receptor; 8886 nM ZINC 10436232, 69 CHEBI:NEW_161540 86593 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002806 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki ZINC 4868730, 70; Ki: 2710.0 nM; Dopamine D3 Receptor; 2710 nM ZINC 4868730, 70 CHEBI:NEW_161520 86594 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002807 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki ZINC 4842613, 71; Ki: 488.0 nM; Dopamine D3 Receptor; 488 nM ZINC 4842613, 71 CHEBI:NEW_161541 86595 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002808 curatus P35462 1814 DRD3 Homo sapiens 9606 Comment/biophysicochemical properties/Ki ZINC 7538899, 72; Ki: 817.0 nM; Dopamine D3 Receptor; 817 nM ZINC 7538899, 72 CHEBI:NEW_161542 86596 pH: 7.4; temp: 22.00 C Y Y PubMed:21926995 BindingDB AAE 9/1/2014 0 2200002809 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 JNK-IN-1; IC50: 4230.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 4230 nM JNK-IN-1 CHEBI:NEW_161543 86626 Y Y PubMed:22284361 BindingDB DGA, AAE 9/1/2014 0 2200002810 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 JNK-IN-2; IC50: 1140.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 1140 nM JNK-IN-2 CHEBI:NEW_161544 86627 Y Y PubMed:22284361 BindingDB DGA, AAE 9/1/2014 0 2200002811 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 JNK-IN-3; IC50: >10000 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 10000 nM JNK-IN-3 CHEBI:NEW_161545 86628 Y Y PubMed:22284361 BindingDB DGA, AAE 9/1/2014 0 2200002812 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 JNK-IN-4; IC50: 5460.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 5460 nM JNK-IN-4 CHEBI:NEW_161546 86629 Y Y PubMed:22284361 BindingDB DGA, AAE 9/1/2014 0 2200002813 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 JNK-IN-5; IC50: 1.93 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 1.93 nM JNK-IN-5 CHEBI:NEW_161547 86630 Y Y PubMed:22284361 BindingDB DGA, AAE 9/1/2014 0 2200002814 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 JNK-IN-7; IC50: 1.99 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 1.99 nM JNK-IN-7 CHEBI:NEW_161548 86632 Y Y PubMed:22284361 BindingDB DGA, AAE 9/1/2014 0 2200002815 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 JNK-IN-8; IC50: 18.7 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 18.7 nM JNK-IN-8 CHEBI:NEW_161549 86633 Y Y PubMed:22284361 BindingDB DGA, AAE 9/1/2014 0 2200002816 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 JNK-IN-11; IC50: 0.5 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 0.5 nM JNK-IN-11 CHEBI:NEW_161550 86636 Y Y PubMed:22284361 BindingDB DGA, AAE 9/1/2014 0 2200002817 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 JNK-IN-12; IC50: 11.3 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 11.3 nM JNK-IN-12 CHEBI:NEW_161551 86637 Y Y PubMed:22284361 BindingDB DGA, AAE 9/1/2014 0 2200002818 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 SP600125; IC50: 110.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 110 nM SP600125 CHEBI:NEW_161552 16018 Y Y PubMed:22284361 BindingDB DGA, AAE 9/1/2014 0 2200002819 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 CHEMBL191384; IC50: 220.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 220 nM CHEMBL191384 CHEBI:NEW_161553 50169959 Y Y PubMed:22284361 BindingDB DGA, AAE 9/1/2014 0 2200002820 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Epoxyazadiradione; IC50: 6400.0 nM; Macrophage migration inhibitory factor (MIF); CHEBI:67285 (epoxyazadiradione) 6400 nM epoxyazadiradione CHEBI:67285 92409 Y Y ECO:0000006 PubMed:22645149 BindingDB DGA, AAE 9/1/2014 0 2200002821 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Azadiradione; IC50: 35200.0 nM; Macrophage migration inhibitory factor (MIF); CHEBI:67280 (azadiradione) 35200 nM azadiradione CHEBI:67280 92410 Y Y ECO:0000006 PubMed:22645149 BindingDB DGA, AAE 9/1/2014 0 2200002822 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Salannin; IC50: 85300.0 nM; Macrophage migration inhibitory factor (MIF); CHEBI:67309 (salannin) 85300 nM salannin CHEBI:67309 92411 Y Y ECO:0000006 PubMed:22645149 BindingDB DGA, AAE 9/1/2014 0 2200002823 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Nimbin; IC50: 17500.0 nM; Macrophage migration inhibitory factor (MIF); CHEBI:67304 (nimbin) 17500 nM nimbin CHEBI:67304 92412 Y Y ECO:0000006 PubMed:22645149 BindingDB DGA, AAE 9/1/2014 0 2200002824 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/Ki BTB 09588, 1; Ki: 860.0 nM; Macrophage migration inhibitory factor (MIF); 860 nM BTB 09588, 1 CHEBI:NEW_161554 92506 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002825 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/IC50 BTB 09588, 1; IC50: 2450.0 nM; Macrophage migration inhibitory factor (MIF); 2450 nM BTB 09588, 1 CHEBI:NEW_161554 92506 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002826 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/Ki DFP 00129, 2; Ki: 2470.0 nM; Macrophage migration inhibitory factor (MIF); 2470 nM DFP 00129, 2 CHEBI:NEW_161555 92507 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002827 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/IC50 DFP 00129, 2; IC50: 7080.0 nM; Macrophage migration inhibitory factor (MIF); 7080 nM DFP 00129, 2 CHEBI:NEW_161555 92507 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002828 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/Ki DP 00477, 3; Ki: 1840.0 nM; Macrophage migration inhibitory factor (MIF); 1840 nM DP 00477, 3 CHEBI:NEW_161556 92508 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002829 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/IC50 DP 00477, 3; IC50: 33110.0 nM; Macrophage migration inhibitory factor (MIF); 33110 nM DP 00477, 3 CHEBI:NEW_161556 92508 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002830 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/Ki HTS 11308, 4; Ki: 2850.0 nM; Macrophage migration inhibitory factor (MIF); 2850 nM HTS 11308, 4 CHEBI:NEW_161557 92509 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002831 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/IC50 HTS 11308, 4; IC50: 4570.0 nM; Macrophage migration inhibitory factor (MIF); 4570 nM HTS 11308, 4 CHEBI:NEW_161557 92509 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002832 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/Ki cid_2816532; Ki: 190.0 nM; Macrophage migration inhibitory factor (MIF); 190 nM cid_2816532 CHEBI:NEW_161558 63895 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002833 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/IC50 cid_2816532; IC50: 1410.0 nM; Macrophage migration inhibitory factor (MIF); 1410 nM cid_2816532 CHEBI:NEW_161558 63895 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002834 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/Ki JFD 03186, 6; Ki: 1580.0 nM; Macrophage migration inhibitory factor (MIF); 1580 nM JFD 03186, 6 CHEBI:NEW_161559 92510 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002835 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/IC50 JFD 03186, 6; IC50: 1950.0 nM; Macrophage migration inhibitory factor (MIF); 1950 nM JFD 03186, 6 CHEBI:NEW_161559 92510 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002836 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/Ki JFD 03990, 7; Ki: 230.0 nM; Macrophage migration inhibitory factor (MIF); 230 nM JFD 03990, 7 CHEBI:NEW_161560 92511 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002837 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/IC50 JFD 03990, 7; IC50: 1550.0 nM; Macrophage migration inhibitory factor (MIF); 1550 nM JFD 03990, 7 CHEBI:NEW_161560 92511 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002838 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/IC50 KM 05004, 8; IC50: 3020.0 nM; Macrophage migration inhibitory factor (MIF); 3020 nM KM 05004, 8 CHEBI:NEW_161561 92512 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002839 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/Ki ML 00144, 9; Ki: 1810.0 nM; Macrophage migration inhibitory factor (MIF); 1810 nM ML 00144, 9 CHEBI:NEW_161562 92513 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002840 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/IC50 ML 00144, 9; IC50: 16980.0 nM; Macrophage migration inhibitory factor (MIF); 16980 nM ML 00144, 9 CHEBI:NEW_161562 92513 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002841 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/IC50 NRB 04242, 10; IC50: 14790.0 nM; Macrophage migration inhibitory factor (MIF); 14790 nM NRB 04242, 10 CHEBI:NEW_161563 92514 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002842 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/Ki RDR 03785, 11; Ki: 570.0 nM; Macrophage migration inhibitory factor (MIF); 570 nM RDR 03785, 11 CHEBI:NEW_161564 92515 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002843 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/IC50 RDR 03785, 11; IC50: 2400.0 nM; Macrophage migration inhibitory factor (MIF); 2400 nM RDR 03785, 11 CHEBI:NEW_161564 92515 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002844 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/Ki RF 00032, 12; Ki: 740.0 nM; Macrophage migration inhibitory factor (MIF); 740 nM RF 00032, 12 CHEBI:NEW_161565 92516 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002845 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/IC50 RF 00032, 12; IC50: 3470.0 nM; Macrophage migration inhibitory factor (MIF); 3470 nM RF 00032, 12 CHEBI:NEW_161565 92516 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002846 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/Ki RJC 02246, 13; Ki: 5310.0 nM; Macrophage migration inhibitory factor (MIF); 5310 nM RJC 02246, 13 CHEBI:NEW_161566 92517 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002847 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/IC50 RJC 02246, 13; IC50: 15140.0 nM; Macrophage migration inhibitory factor (MIF); 15140 nM RJC 02246, 13 CHEBI:NEW_161566 92517 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002848 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/Ki RJC 04082, 14; Ki: 450.0 nM; Macrophage migration inhibitory factor (MIF); 450 nM RJC 04082, 14 CHEBI:NEW_161567 92518 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002849 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/IC50 RJC 04082, 14; IC50: 3020.0 nM; Macrophage migration inhibitory factor (MIF); 3020 nM RJC 04082, 14 CHEBI:NEW_161567 92518 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002850 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/Ki cid_2732003; Ki: 1300.0 nM; Macrophage migration inhibitory factor (MIF); 1300 nM cid_2732003 CHEBI:NEW_161568 32847 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002851 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/IC50 cid_2732003; IC50: 3310.0 nM; Macrophage migration inhibitory factor (MIF); 3310 nM cid_2732003 CHEBI:NEW_161568 32847 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002852 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/Ki cid_3598; Ki: 5550.0 nM; Macrophage migration inhibitory factor (MIF); 5550 nM cid_3598 CHEBI:NEW_161569 31712 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002853 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/IC50 cid_3598; IC50: 6000.0 nM; Macrophage migration inhibitory factor (MIF); 6000 nM cid_3598 CHEBI:NEW_161569 31712 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002854 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/Ki CHEMBL55285; Ki: 790.0 nM; Macrophage migration inhibitory factor (MIF); CHEBI:17484 (benzyl isothiocyanate) 790 nM benzyl isothiocyanate CHEBI:17484 50240520 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002855 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/IC50 CHEMBL55285; IC50: 6500.0 nM; Macrophage migration inhibitory factor (MIF); CHEBI:17484 (benzyl isothiocyanate) 6500 nM benzyl isothiocyanate CHEBI:17484 50240520 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002856 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/Ki cid_3194; Ki: 570.0 nM; Macrophage migration inhibitory factor (MIF); 570 nM cid_3194 CHEBI:NEW_161570 34233 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002857 curatus P14174 4282 MIF Homo sapiens 9606 Comment/biophysicochemical properties/IC50 cid_3194; IC50: 2400.0 nM; Macrophage migration inhibitory factor (MIF); 2400 nM cid_3194 CHEBI:NEW_161570 34233 pH: 6.5; Y Y ECO:0000006 PubMed:20516071 BindingDB DGA, AAE 9/1/2014 0 2200002858 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 9-hydroxy pyrazoloquinolinone 1; IC50: 3100.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 3100 nM 9-hydroxy pyrazoloquinolinone 1 CHEBI:NEW_161571 15868 pH: 7.2; temp: 20.00 C Y Y ECO:0000006 PubMed:16527482 BindingDB #12 in references and notes DGA, AAE 9/1/2014 0 2200002859 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 9-hydroxy pyrazoloquinolinone 2; IC50: 3000.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 3000 nM 9-hydroxy pyrazoloquinolinone 2 CHEBI:NEW_161572 15869 pH: 7.2; temp: 20.00 C Y Y ECO:0000006 PubMed:16527482 BindingDB #12 in the notes and references section DGA, AAE 9/1/2014 0 2200002860 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 2-pyridinecarboxamide deriv. 3; IC50: 120.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 120 nM 2-pyridinecarboxamide deriv. 3 CHEBI:NEW_161573 15909 pH: 7.2; temp: 20.00 C Y Y PubMed:16854050 BindingDB DGA, AAE 9/1/2014 0 2200002861 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 2-pyridinecarboxamide deriv. 8a; IC50: 610.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 610 nM 2-pyridinecarboxamide deriv. 8a CHEBI:NEW_161574 15911 pH: 7.2; temp: 20.00 C Y Y PubMed:16854050 BindingDB DGA, AAE 9/1/2014 0 2200002862 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 2-pyridinecarboxamide deriv. 8b; IC50: 190.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 190 nM 2-pyridinecarboxamide deriv. 8b CHEBI:NEW_161575 15912 pH: 7.2; temp: 20.00 C Y Y PubMed:16854050 BindingDB DGA, AAE 9/1/2014 0 2200002863 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 2-pyridinecarboxamide deriv. 8c; IC50: 120.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 120 nM 2-pyridinecarboxamide deriv. 8c CHEBI:NEW_161576 15913 pH: 7.2; temp: 20.00 C Y Y PubMed:16854050 BindingDB DGA, AAE 9/1/2014 0 2200002864 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 2-pyridinecarboxamide deriv. 8d; IC50: 53.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 53 nM 2-pyridinecarboxamide deriv. 8d CHEBI:NEW_161577 15914 pH: 7.2; temp: 20.00 C Y Y PubMed:16854050 BindingDB DGA, AAE 9/1/2014 0 2200002865 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 2-pyridinecarboxamide deriv. 8e; IC50: 41.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 41 nM 2-pyridinecarboxamide deriv. 8e CHEBI:NEW_161578 15915 pH: 7.2; temp: 20.00 C Y Y PubMed:16854050 BindingDB DGA, AAE 9/1/2014 0 2200002866 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 2-pyridinecarboxamide deriv. 8f; IC50: 11.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 11 nM 2-pyridinecarboxamide deriv. 8f CHEBI:NEW_161579 15916 pH: 7.2; temp: 20.00 C Y Y PubMed:16854050 BindingDB DGA, AAE 9/1/2014 0 2200002867 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 2-pyridinecarboxamide deriv. 8g; IC50: >10000 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 10000 nM 2-pyridinecarboxamide deriv. 8g CHEBI:NEW_161580 15917 pH: 7.2; temp: 20.00 C Y Y PubMed:16854050 BindingDB DGA, AAE 9/1/2014 0 2200002868 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 2-pyridinecarboxamide deriv. 12; IC50: 74.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 74 nM 2-pyridinecarboxamide deriv. 12 CHEBI:NEW_161581 15918 pH: 7.2; temp: 20.00 C Y Y PubMed:16854050 BindingDB DGA, AAE 9/1/2014 0 2200002869 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 2-pyridinecarboxamide deriv. 13; IC50: 68.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 68 nM 2-pyridinecarboxamide deriv. 13 CHEBI:NEW_161582 15919 pH: 7.2; temp: 20.00 C Y Y PubMed:16854050 BindingDB DGA, AAE 9/1/2014 0 2200002870 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 2-pyridinecarboxamide deriv. 15; IC50: 4400.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 4400 nM 2-pyridinecarboxamide deriv. 15 CHEBI:NEW_161583 15920 pH: 7.2; temp: 20.00 C Y Y PubMed:16854050 BindingDB DGA, AAE 9/1/2014 0 2200002871 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 aminopyridine deriv. 1; IC50: 1100.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 1100 nM 15907 pH: 7.2; temp: 20.00 C Y Y ECO:0000006 PubMed:16759099 BindingDB aminopyridine derivative 6a; table 1 DGA, AAE 9/1/2014 0 2200002872 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 6b; IC50: 690.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 690 nM Aminopyridine-Based Inhibitor 6b CHEBI:NEW_161585 15923 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002873 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 6c; IC50: 8400.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 8400 nM Aminopyridine-Based Inhibitor 6c CHEBI:NEW_161586 15924 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002874 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 6d; IC50: 3500.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 3500 nM Aminopyridine-Based Inhibitor 6d CHEBI:NEW_161587 15925 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002875 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 6e; IC50: 770.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 770 nM Aminopyridine-Based Inhibitor 6e CHEBI:NEW_161588 15926 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002876 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 6f; IC50: 4900.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 4900 nM Aminopyridine-Based Inhibitor 6f CHEBI:NEW_161589 15927 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002877 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 6g; IC50: 900.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 900 nM Aminopyridine-Based Inhibitor 6g CHEBI:NEW_161590 15928 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002878 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 6h; IC50: 610.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 610 nM Aminopyridine-Based Inhibitor 6h CHEBI:NEW_161591 15929 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002879 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 6i; IC50: 740.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 740 nM Aminopyridine-Based Inhibitor 6i CHEBI:NEW_161592 15930 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002880 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 6j; IC50: 790.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 790 nM Aminopyridine-Based Inhibitor 6j CHEBI:NEW_161593 15931 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002881 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 6k; IC50: 360.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 360 nM Aminopyridine-Based Inhibitor 6k CHEBI:NEW_161594 15932 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002882 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 6l; IC50: 260.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 260 nM Aminopyridine-Based Inhibitor 6l CHEBI:NEW_161595 15933 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002883 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 6m; IC50: 310.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 310 nM Aminopyridine-Based Inhibitor 6m CHEBI:NEW_161596 15934 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002884 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 6n; IC50: 274.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 274 nM Aminopyridine-Based Inhibitor 6n CHEBI:NEW_161597 15935 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002885 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 aminopyridine deriv. 2; IC50: 160.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 160 nM aminopyridine deriv. 2 CHEBI:NEW_161598 15908 pH: 7.2; temp: 20.00 C Y Y ECO:0000006 PubMed:16759099 BindingDB aminopyridine derivative 6o; table 1 DGA, AAE 9/1/2014 0 2200002886 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/Ki aminopyridine deriv. 1; Ki: 440.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 440 nM 15907 pH: 7.5; temp: 22.00 C Y Y ECO:0000006 PubMed:16759099 BindingDB aminopyridine derivative 6a; table 5 DGA, AAE 9/1/2014 0 2200002887 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/Ki aminopyridine deriv. 2; Ki: 4.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 4 nM 15908 pH: 7.5; temp: 22.00 C Y Y ECO:0000006 PubMed:16759099 BindingDB aminopyridine derivative 6o; table 5 DGA, AAE 9/1/2014 0 2200002888 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 6p; IC50: >10000 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 10000 nM Aminopyridine-Based Inhibitor 6p CHEBI:NEW_161599 15936 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002889 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 6q; IC50: >10000 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 10000 nM Aminopyridine-Based Inhibitor 6q CHEBI:NEW_161600 15937 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002890 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 6r; IC50: 26.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 26 nM Aminopyridine-Based Inhibitor 6r CHEBI:NEW_161601 15938 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002891 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 6s; IC50: 150.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 150 nM Aminopyridine-Based Inhibitor 6s CHEBI:NEW_161602 15939 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002892 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 6t; IC50: 160.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 160 nM Aminopyridine-Based Inhibitor 6t CHEBI:NEW_161603 15940 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002893 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 6u; IC50: 100.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 100 nM Aminopyridine-Based Inhibitor 6u CHEBI:NEW_161604 15941 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002894 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 7; IC50: >10000 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 10000 nM Aminopyridine-Based Inhibitor 7 CHEBI:NEW_161605 15942 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002895 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 8; IC50: >10000 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 10000 nM Aminopyridine-Based Inhibitor 8 CHEBI:NEW_161606 15943 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002896 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 10; IC50: >10000 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 10000 nM Aminopyridine-Based Inhibitor 10 CHEBI:NEW_161607 15944 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002897 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 28a; IC50: 6300.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 6300 nM Aminopyridine-Based Inhibitor 28a CHEBI:NEW_161608 15945 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002898 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 28b; IC50: >10000 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 10000 nM Aminopyridine-Based Inhibitor 28b CHEBI:NEW_161609 15946 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002899 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 28c; IC50: >10000 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 10000 nM Aminopyridine-Based Inhibitor 28c CHEBI:NEW_161610 15947 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002900 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 28d; IC50: 740.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 740 nM Aminopyridine-Based Inhibitor 28d CHEBI:NEW_161611 15948 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002901 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 29; IC50: 3400.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 3400 nM Aminopyridine-Based Inhibitor 29 CHEBI:NEW_161612 15949 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002902 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 30; IC50: 1200.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 1200 nM Aminopyridine-Based Inhibitor 30 CHEBI:NEW_161613 15950 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002903 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Aminopyridine-Based Inhibitor 6s; Ki: 9.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 9 nM Aminopyridine-Based Inhibitor 6s CHEBI:NEW_161602 15939 pH: 7.5; temp: 22.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002904 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 31; IC50: 640.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 640 nM Aminopyridine-Based Inhibitor 31 CHEBI:NEW_161614 15951 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002905 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 33; IC50: 180.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 180 nM Aminopyridine-Based Inhibitor 33 CHEBI:NEW_161615 15952 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002906 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 34; IC50: 130.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 130 nM Aminopyridine-Based Inhibitor 34 CHEBI:NEW_161616 15953 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002907 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 17; IC50: >10000 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 10000 nM Aminopyridine-Based Inhibitor 17 CHEBI:NEW_161617 15954 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002908 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 18a; IC50: 470.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 470 nM Aminopyridine-Based Inhibitor 18a CHEBI:NEW_161618 15955 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002909 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 18b; IC50: 64.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 64 nM Aminopyridine-Based Inhibitor 18b CHEBI:NEW_161619 15956 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002910 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 19a; IC50: >10000 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 10000 nM Aminopyridine-Based Inhibitor 19a CHEBI:NEW_161620 15957 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002911 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 19b; IC50: 4900.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 4900 nM Aminopyridine-Based Inhibitor 19b CHEBI:NEW_161621 15958 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002912 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 19c; IC50: 2900.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 2900 nM Aminopyridine-Based Inhibitor 19c CHEBI:NEW_161622 15959 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002913 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 19d; IC50: 4663.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 4663 nM Aminopyridine-Based Inhibitor 19d CHEBI:NEW_161623 15960 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002914 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 19e; IC50: 4500.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 4500 nM Aminopyridine-Based Inhibitor 19e CHEBI:NEW_161624 15961 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002915 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 20a; IC50: 240.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 240 nM Aminopyridine-Based Inhibitor 20a CHEBI:NEW_161625 15962 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002916 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 20b; IC50: 270.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 270 nM Aminopyridine-Based Inhibitor 20b CHEBI:NEW_161626 15963 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002917 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 20c; IC50: 740.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 740 nM Aminopyridine-Based Inhibitor 20c CHEBI:NEW_161627 15964 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002918 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 21; IC50: >10000 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 10000 nM Aminopyridine-Based Inhibitor 21 CHEBI:NEW_161628 15965 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002919 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Aminopyridine-Based Inhibitor 18b; Ki: 4.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 4 nM Aminopyridine-Based Inhibitor 18b CHEBI:NEW_161619 15956 pH: 7.5; temp: 22.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002920 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 22; IC50: >10000 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 10000 nM Aminopyridine-Based Inhibitor 22 CHEBI:NEW_161629 15966 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002921 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 23; IC50: 3000.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 3000 nM Aminopyridine-Based Inhibitor 23 CHEBI:NEW_161630 15967 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002922 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 24; IC50: 7700.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 7700 nM Aminopyridine-Based Inhibitor 24 CHEBI:NEW_161631 15968 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002923 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 25; IC50: >10000 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 10000 nM Aminopyridine-Based Inhibitor 25 CHEBI:NEW_161632 15969 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002924 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 26; IC50: 5100.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 5100 nM Aminopyridine-Based Inhibitor 26 CHEBI:NEW_161633 15970 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002925 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 39; IC50: >10000 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 10000 nM Aminopyridine-Based Inhibitor 39 CHEBI:NEW_161634 15971 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002926 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 46; IC50: >10000 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 10000 nM Aminopyridine-Based Inhibitor 46 CHEBI:NEW_161635 15972 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002927 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 43; IC50: >10000 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 10000 nM Aminopyridine-Based Inhibitor 43 CHEBI:NEW_161636 15973 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002928 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 41; IC50: >10000 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 10000 nM Aminopyridine-Based Inhibitor 41 CHEBI:NEW_161637 15974 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002929 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 42; IC50: >10000 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 10000 nM Aminopyridine-Based Inhibitor 42 CHEBI:NEW_161638 15975 pH: 7.2; temp: 20.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002930 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Aminopyridine-Based Inhibitor 35; IC50: 70.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 70 nM Aminopyridine-Based Inhibitor 35 CHEBI:NEW_161639 15976 pH: 7.2; temp: 20.00 C Y Y ECO:0000006 PubMed:16759099 BindingDB table 5 DGA, AAE 9/1/2014 0 2200002931 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Aminopyridine-Based Inhibitor 24; Ki: 1900.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 1900 nM Aminopyridine-Based Inhibitor 24 CHEBI:NEW_161631 15968 pH: 7.5; temp: 22.00 C Y Y ECO:0000006 PubMed:16759099 BindingDB table 5 DGA, AAE 9/1/2014 0 2200002932 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/Ki Aminopyridine-Based Inhibitor 35; Ki: 13.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 13 nM Aminopyridine-Based Inhibitor 35 CHEBI:NEW_161639 15976 pH: 7.5; temp: 22.00 C Y Y PubMed:16759099 BindingDB DGA, AAE 9/1/2014 0 2200002933 curatus Q969F8 84634 KISS1R Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Peptide analogue, 1; IC50: 0.71 nM; G-protein Coupled Receptor 54; 0.71 nM Peptide analogue, 1 CHEBI:NEW_161687 26338 pH: 7.3; temp: 25.00 C Y Y PubMed:19007202 BindingDB AAE 9/1/2014 0 2200002984 curatus Q969F8 84634 KISS1R Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Peptide analogue, 19; IC50: 0.12 nM; G-protein Coupled Receptor 54; 0.12 nM Peptide analogue, 19 CHEBI:NEW_161688 26339 pH: 7.3; temp: 25.00 C Y Y PubMed:19007202 BindingDB AAE 9/1/2014 0 2200002985 curatus Q969F8 84634 KISS1R Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Peptide analogue, 20; IC50: 1.2 nM; G-protein Coupled Receptor 54; 1.2 nM Peptide analogue, 20 CHEBI:NEW_161689 26340 pH: 7.3; temp: 25.00 C Y Y PubMed:19007202 BindingDB AAE 9/1/2014 0 2200002986 curatus Q969F8 84634 KISS1R Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Peptide analogue, 21; IC50: 4.6 nM; G-protein Coupled Receptor 54; 4.6 nM Peptide analogue, 21 CHEBI:NEW_161690 26341 pH: 7.3; temp: 25.00 C Y Y PubMed:19007202 BindingDB AAE 9/1/2014 0 2200002987 curatus Q969F8 84634 KISS1R Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Peptide analogue, 22; IC50: 32.0 nM; G-protein Coupled Receptor 54; 32 nM Peptide analogue, 22 CHEBI:NEW_161691 26342 pH: 7.3; temp: 25.00 C Y Y PubMed:19007202 BindingDB AAE 9/1/2014 0 2200002988 curatus Q969F8 84634 KISS1R Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Peptide analogue, 23; IC50: 460.0 nM; G-protein Coupled Receptor 54; 460 nM Peptide analogue, 23 CHEBI:NEW_161692 26343 pH: 7.3; temp: 25.00 C Y Y PubMed:19007202 BindingDB AAE 9/1/2014 0 2200002989 curatus Q969F8 84634 KISS1R Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Peptide analogue, 24a; IC50: 380.0 nM; G-protein Coupled Receptor 54; 380 nM Peptide analogue, 24a CHEBI:NEW_161693 26344 pH: 7.3; temp: 25.00 C Y Y PubMed:19007202 BindingDB AAE 9/1/2014 0 2200002990 curatus Q969F8 84634 KISS1R Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Peptide analogue, 24b; IC50: 5.7 nM; G-protein Coupled Receptor 54; 5.7 nM Peptide analogue, 24b CHEBI:NEW_161694 26345 pH: 7.3; temp: 25.00 C Y Y PubMed:19007202 BindingDB AAE 9/1/2014 0 2200002991 curatus Q969F8 84634 KISS1R Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Peptide analogue, 25a; IC50: 32.0 nM; G-protein Coupled Receptor 54; 32 nM Peptide analogue, 25a CHEBI:NEW_161695 26346 pH: 7.3; temp: 25.00 C Y Y PubMed:19007202 BindingDB AAE 9/1/2014 0 2200002992 curatus Q969F8 84634 KISS1R Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Peptide analogue, 25b; IC50: 0.24 nM; G-protein Coupled Receptor 54; 0.24 nM Peptide analogue, 25b CHEBI:NEW_161696 26347 pH: 7.3; temp: 25.00 C Y Y PubMed:19007202 BindingDB AAE 9/1/2014 0 2200002993 curatus Q969F8 84634 KISS1R Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Peptide analogue, 26; IC50: 240.0 nM; G-protein Coupled Receptor 54; 240 nM Peptide analogue, 26 CHEBI:NEW_161697 26348 pH: 7.3; temp: 25.00 C Y Y PubMed:19007202 BindingDB AAE 9/1/2014 0 2200002994 curatus Q969F8 84634 KISS1R Homo sapiens 9606 Comment/biophysicochemical properties/IC50 Kisspeptin-10; IC50: 0.12 nM; G-protein Coupled Receptor 54; 0.12 nM Kisspeptin-10 CHEBI:NEW_161698 26349 pH: 7.3; temp: 25.00 C Y Y PubMed:19007202 BindingDB AAE 9/1/2014 0 2200002995 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/Kd BAY 439006; Kd: 3600.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); CHEBI:50924 (sorafenib) 3600 nM sorafenib CHEBI:50924 16673 Y Y PubMed:15711537 BindingDB DGA, AAE 9/1/2014 0 2200002996 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/Kd Imatinib; Kd: 5200.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); CHEBI:45783 (imatinib) 5200 nM imatinib CHEBI:45783 13530 Y Y PubMed:15711537 BindingDB DGA, AAE 9/1/2014 0 2200002997 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/Kd SB203580; Kd: 95.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 95 nM SB203580 CHEBI:NEW_161699 13336 Y Y PubMed:15711537 BindingDB DGA, AAE 9/1/2014 0 2200002998 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/Kd Iressa; Kd: 1400.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); CHEBI:49668 (gefitinib) 1400 nM gefitinib CHEBI:49668 5447 Y Y PubMed:15711537 BindingDB DGA, AAE 9/1/2014 0 2200002999 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/Kd CI-1033; Kd: 1100.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); CHEBI:61399 (canertinib) 1100 nM canertinib CHEBI:61399 4779 Y Y PubMed:15711537 BindingDB DGA, AAE 9/1/2014 0 2200003000 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/Kd SP600125; Kd: 84.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 84 nM SP600125 CHEBI:NEW_161552 16018 Y Y PubMed:15711537 BindingDB DGA, AAE 9/1/2014 0 2200003001 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/Kd Tarceva; Kd: 4000.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); CHEBI:114785 (erlotinib) 4000 nM erlotinib CHEBI:114785 5446 Y Y PubMed:15711537 BindingDB DGA, AAE 9/1/2014 0 2200003002 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/Kd SB-202190; Kd: 120.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 120 nM SB-202190 CHEBI:NEW_161700 50104383 Y Y PubMed:15711537 BindingDB DGA, AAE 9/1/2014 0 2200003003 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/Kd BIRB-796; Kd: 5.6 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 5.6 nM BIRB-796 CHEBI:NEW_161701 13533 Y Y PubMed:15711537 BindingDB DGA, AAE 9/1/2014 0 2200003004 curatus P43405 6850 SYK Homo sapiens 9606 Comment/biophysicochemical properties/Kd CHEMBL162; Kd: 7.0 nM; Tyrosine Kinase Syk; 7 nM CHEMBL162 CHEBI:NEW_161702 50059889 Y Y ECO:0000006 PubMed:15711537 BindingDB AAE 9/1/2014 0 2200003005 curatus P45984 5601 MAPK9 Homo sapiens 9606 Comment/biophysicochemical properties/Kd CHEMBL162; Kd: 1100.0 nM; Mitogen-Activated Protein Kinase 9 (JNK2); 1100 nM CHEMBL162 CHEBI:NEW_161702 50059889 Staurosporine Y Y PubMed:15711537 BindingDB DGA, AAE 9/1/2014 0 2200003006 curatus P43405 6850 SYK Homo sapiens 9606 Comment/biophysicochemical properties/Kd cid_6445562; Kd: 1200.0 nM; Tyrosine Kinase Syk; CHEBI:38927 (pelitinib) 1200 nM pelitinib CHEBI:38927 31090 Y Y ECO:0000006 PubMed:15711537 BindingDB AAE 9/1/2014 0 2200003007 curatus Q96EB6 23411 SIRT1 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 cambinol; IC50: 40700.0 nM; NAD-Dependent Deacetylase Sirtuin-1; 40700 nM cambinol CHEBI:NEW_161705 29040 pH: 8; temp: 37.00 C Y Y ECO:0000006 PubMed:19419202 BindingDB DGA, AAE 9/1/2014 0 2200003010 curatus Q96EB6 23411 SIRT1 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 cambinol analog, 6b; IC50: 12700.0 nM; NAD-Dependent Deacetylase Sirtuin-1; 12700 nM cambinol analog, 6b CHEBI:NEW_161706 29042 pH: 8; temp: 37.00 C Y Y ECO:0000006 PubMed:19419202 BindingDB DGA, AAE 9/1/2014 0 2200003011 curatus Q96EB6 23411 SIRT1 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 cambinol analog, 6i; IC50: 43000.0 nM; NAD-Dependent Deacetylase Sirtuin-1; 43000 nM cambinol analog, 6i CHEBI:NEW_161707 29045 pH: 8; temp: 37.00 C Y Y ECO:0000006 PubMed:19419202 BindingDB DGA, AAE 9/1/2014 0 2200003012 curatus Q96EB6 23411 SIRT1 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 cambinol analog, 6ii; IC50: 44200.0 nM; NAD-Dependent Deacetylase Sirtuin-1; 44200 nM cambinol analog, 6ii CHEBI:NEW_161708 29046 pH: 8; temp: 37.00 C Y Y ECO:0000006 PubMed:19419202 BindingDB DGA, AAE 9/1/2014 0 2200003013 curatus Q96EB6 23411 SIRT1 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 cambinol analog, 6iii; IC50: 44500.0 nM; NAD-Dependent Deacetylase Sirtuin-1; 44500 nM cambinol analog, 6iii CHEBI:NEW_161709 29047 pH: 8; temp: 37.00 C Y Y ECO:0000006 PubMed:19419202 BindingDB DGA, AAE 9/1/2014 0 2200003014 curatus Q96EB6 23411 SIRT1 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 cambinol analog, 6x; IC50: 50000.0 nM; NAD-Dependent Deacetylase Sirtuin-1; 50000 nM cambinol analog, 6x CHEBI:NEW_161710 29054 pH: 8; temp: 37.00 C Y Y ECO:0000006 PubMed:19419202 BindingDB DGA, AAE 9/1/2014 0 2200003015 curatus Q96EB6 23411 SIRT1 Homo sapiens 9606 Comment/biophysicochemical properties/IC50 cambinol analog, 6xi; IC50: 38300.0 nM; NAD-Dependent Deacetylase Sirtuin-1; 38300 nM cambinol analog, 6xi CHEBI:NEW_161711 29055 pH: 8; temp: 37.00 C Y Y ECO:0000006 PubMed:19419202 BindingDB DGA, AAE 9/1/2014 0 2200003016 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki benzazepinelidene acetamide derivative, 1b; Ki: 28.0 nM; Vasopressin V1a Receptor; 28 nM benzazepinelidene acetamide derivative, 1b CHEBI:NEW_161713 35666 pH: 7.4; temp: 23.00 C Y Y PubMed:19900813 BindingDB DGA, AAE 9/1/2014 0 2200003018 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki benzazepinelidene acetamide derivative, 1c; Ki: 170.0 nM; Vasopressin V1a Receptor; 170 nM benzazepinelidene acetamide derivative, 1c CHEBI:NEW_161714 35668 pH: 7.4; temp: 23.00 C Y Y PubMed:19900813 BindingDB DGA, AAE 9/1/2014 0 2200003019 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki benzazepinelidene acetamide derivative, 1d; Ki: 13.0 nM; Vasopressin V1a Receptor; 13 nM benzazepinelidene acetamide derivative, 1d CHEBI:NEW_161715 35669 pH: 7.4; temp: 23.00 C Y Y PubMed:19900813 BindingDB DGA, AAE 9/1/2014 0 2200003020 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki benzazepinelidene acetamide derivative, 1e; Ki: 39.0 nM; Vasopressin V1a Receptor; 39 nM benzazepinelidene acetamide derivative, 1e CHEBI:NEW_161716 35670 pH: 7.4; temp: 23.00 C Y Y PubMed:19900813 BindingDB DGA, AAE 9/1/2014 0 2200003021 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki benzazepinelidene acetamide derivative, 1f; Ki: 17.0 nM; Vasopressin V1a Receptor; 17 nM benzazepinelidene acetamide derivative, 1f CHEBI:NEW_161717 35671 pH: 7.4; temp: 23.00 C Y Y PubMed:19900813 BindingDB DGA, AAE 9/1/2014 0 2200003022 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki benzazepinelidene acetamide derivative, 1g; Ki: 43.0 nM; Vasopressin V1a Receptor; 43 nM benzazepinelidene acetamide derivative, 1g CHEBI:NEW_161718 35672 pH: 7.4; temp: 23.00 C Y Y PubMed:19900813 BindingDB DGA, AAE 9/1/2014 0 2200003023 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki 5H-1-benzazepin-5-ylidene acetamide, 1a; Ki: 26.0 nM; Vasopressin V1a Receptor; 26 nM 5H-1-benzazepin-5-ylidene acetamide, 1a CHEBI:NEW_161719 35673 pH: 7.4; temp: 23.00 C Y Y ECO:0000006 PubMed:19321349 BindingDB DGA, AAE 9/1/2014 0 2200003024 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki 5H-1-benzazepin-5-ylidene acetamide, 1b; Ki: 40.0 nM; Vasopressin V1a Receptor; 40 nM 5H-1-benzazepin-5-ylidene acetamide, 1b CHEBI:NEW_161720 35674 pH: 7.4; temp: 23.00 C Y Y ECO:0000006 PubMed:19321349 BindingDB DGA, AAE 9/1/2014 0 2200003025 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki 5H-1-benzazepin-5-ylidene acetamide, 1c; Ki: 15.0 nM; Vasopressin V1a Receptor; 15 nM 5H-1-benzazepin-5-ylidene acetamide, 1c CHEBI:NEW_161721 35675 pH: 7.4; temp: 23.00 C Y Y ECO:0000006 PubMed:19321349 BindingDB DGA, AAE 9/1/2014 0 2200003026 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki 5H-1-benzazepin-5-ylidene acetamide, 1d; Ki: 43.0 nM; Vasopressin V1a Receptor; 43 nM 5H-1-benzazepin-5-ylidene acetamide, 1d CHEBI:NEW_161722 35676 pH: 7.4; temp: 23.00 C Y Y ECO:0000006 PubMed:19321349 BindingDB DGA, AAE 9/1/2014 0 2200003027 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki 5H-1-benzazepin-5-ylidene acetamide, 1e; Ki: 30.0 nM; Vasopressin V1a Receptor; 30 nM 5H-1-benzazepin-5-ylidene acetamide, 1e CHEBI:NEW_161723 35677 pH: 7.4; temp: 23.00 C Y Y PubMed:19321349 BindingDB DGA, AAE 9/1/2014 0 2200003028 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki 5H-1-benzazepin-5-ylidene acetamide, 1f; Ki: 47.0 nM; Vasopressin V1a Receptor; 47 nM 5H-1-benzazepin-5-ylidene acetamide, 1f CHEBI:NEW_161724 35678 pH: 7.4; temp: 23.00 C Y Y PubMed:19321349 BindingDB DGA, AAE 9/1/2014 0 2200003029 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki 5H-1-benzazepin-5-ylidene acetamide, 1g; Ki: 38.0 nM; Vasopressin V1a Receptor; 38 nM 5H-1-benzazepin-5-ylidene acetamide, 1g CHEBI:NEW_161725 35679 pH: 7.4; temp: 23.00 C Y Y PubMed:19321349 BindingDB DGA, AAE 9/1/2014 0 2200003030 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki 5H-1-benzazepin-5-ylidene acetamide, 1h; Ki: 48.0 nM; Vasopressin V1a Receptor; 48 nM 5H-1-benzazepin-5-ylidene acetamide, 1h CHEBI:NEW_161726 35680 pH: 7.4; temp: 23.00 C Y Y PubMed:19321349 BindingDB DGA, AAE 9/1/2014 0 2200003031 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki 5H-1-benzazepin-5-ylidene acetamide, 1i; Ki: 22.0 nM; Vasopressin V1a Receptor; 22 nM 5H-1-benzazepin-5-ylidene acetamide, 1i CHEBI:NEW_161727 35681 pH: 7.4; temp: 23.00 C Y Y PubMed:19321349 BindingDB DGA, AAE 9/1/2014 0 2200003032 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki 5H-1-benzazepin-5-ylidene acetamide, 1j; Ki: 57.0 nM; Vasopressin V1a Receptor; 57 nM 5H-1-benzazepin-5-ylidene acetamide, 1j CHEBI:NEW_161728 35682 pH: 7.4; temp: 23.00 C Y Y PubMed:19321349 BindingDB DGA, AAE 9/1/2014 0 2200003033 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki 5H-1-benzazepin-5-ylidene acetamide, 1k; Ki: 43.0 nM; Vasopressin V1a Receptor; 43 nM 5H-1-benzazepin-5-ylidene acetamide, 1k CHEBI:NEW_161729 35683 pH: 7.4; temp: 23.00 C Y Y PubMed:19321349 BindingDB DGA, AAE 9/1/2014 0 2200003034 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki 5H-1-benzazepin-5-ylidene acetamide, 1l; Ki: 44.0 nM; Vasopressin V1a Receptor; 44 nM 5H-1-benzazepin-5-ylidene acetamide, 1l CHEBI:NEW_161730 35684 pH: 7.4; temp: 23.00 C Y Y PubMed:19321349 BindingDB DGA, AAE 9/1/2014 0 2200003035 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki 5H-1-benzazepin-5-ylidene acetamide, 1m; Ki: 43.0 nM; Vasopressin V1a Receptor; 43 nM 5H-1-benzazepin-5-ylidene acetamide, 1m CHEBI:NEW_161731 35685 pH: 7.4; temp: 23.00 C Y Y PubMed:19321349 BindingDB DGA, AAE 9/1/2014 0 2200003036 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki 5H-1-benzazepin-5-ylidene acetamide, 1n; Ki: 55.0 nM; Vasopressin V1a Receptor; 55 nM 5H-1-benzazepin-5-ylidene acetamide, 1n CHEBI:NEW_161732 35686 pH: 7.4; temp: 23.00 C Y Y PubMed:19321349 BindingDB DGA, AAE 9/1/2014 0 2200003037 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki 5H-1-benzazepin-5-ylidene acetamide, 1o; Ki: 72.0 nM; Vasopressin V1a Receptor; 72 nM 5H-1-benzazepin-5-ylidene acetamide, 1o CHEBI:NEW_161733 35687 pH: 7.4; temp: 23.00 C Y Y PubMed:19321349 BindingDB DGA, AAE 9/1/2014 0 2200003038 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki 5H-1-benzazepin-5-ylidene acetamide, 1p; Ki: 72.0 nM; Vasopressin V1a Receptor; 72 nM 5H-1-benzazepin-5-ylidene acetamide, 1p CHEBI:NEW_161734 35688 pH: 7.4; temp: 23.00 C Y Y PubMed:19321349 BindingDB DGA, AAE 9/1/2014 0 2200003039 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki 5H-1-benzazepin-5-ylidene acetamide, 1q; Ki: 6300.0 nM; Vasopressin V1a Receptor; 6300 nM 5H-1-benzazepin-5-ylidene acetamide, 1q CHEBI:NEW_161735 35689 pH: 7.4; temp: 23.00 C Y Y ECO:0000006 PubMed:19321349 BindingDB DGA, AAE 9/1/2014 0 2200003040 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki 5H-1-benzazepin-5-ylidene acetamide, 1r; Ki: 190.0 nM; Vasopressin V1a Receptor; 190 nM 5H-1-benzazepin-5-ylidene acetamide, 1r CHEBI:NEW_161736 35690 pH: 7.4; temp: 23.00 C Y Y PubMed:19321349 BindingDB DGA, AAE 9/1/2014 0 2200003041 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki 5H-1-benzazepin-5-ylidene acetamide, 1s; Ki: 13.0 nM; Vasopressin V1a Receptor; 13 nM 5H-1-benzazepin-5-ylidene acetamide, 1s CHEBI:NEW_161737 35691 pH: 7.4; temp: 23.00 C Y Y PubMed:19321349 BindingDB DGA, AAE 9/1/2014 0 2200003042 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki benzazepinelidene acetamide derivative, 1b; Ki: 28.0 nM; Vasopressin V1a Receptor; 28 nM benzazepinelidene acetamide derivative, 1b CHEBI:NEW_161713 35666 pH: 7.4; temp: 23.00 C Y Y PubMed:19321349 BindingDB DGA, AAE 9/1/2014 0 2200003043 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki 5H-1-benzazepin-5-ylidene acetamide, 1u; Ki: 59.0 nM; Vasopressin V1a Receptor; 59 nM 5H-1-benzazepin-5-ylidene acetamide, 1u CHEBI:NEW_161738 35692 pH: 7.4; temp: 23.00 C Y Y PubMed:19321349 BindingDB DGA, AAE 9/1/2014 0 2200003044 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki 5H-1-benzazepin-5-ylidene acetamide, 1v; Ki: 230.0 nM; Vasopressin V1a Receptor; 230 nM 5H-1-benzazepin-5-ylidene acetamide, 1v CHEBI:NEW_161739 35693 pH: 7.4; temp: 23.00 C Y Y PubMed:19321349 BindingDB DGA, AAE 9/1/2014 0 2200003045 curatus P37288 552 AVPR1A Homo sapiens 9606 Comment/biophysicochemical properties/Ki 5H-1-benzazepin-5-ylidene acetamide, 1w; Ki: 40.0 nM; Vasopressin V1a Receptor; 40 nM 5H-1-benzazepin-5-ylidene acetamide, 1w CHEBI:NEW_161740 35694 pH: 7.4; temp: 23.00 C Y Y PubMed:19321349 BindingDB DGA, AAE 9/1/2014 0 2200003046 curatus P43405 6850 SYK Homo sapiens 9606 Comment/biophysicochemical properties/IC50 1,2,4-Oxadiazole Analogue 5j; IC50: 472000.0 nM; Tyrosine Kinase Syk; 472000 nM 1,2,4-Oxadiazole Analogue 5j CHEBI:NEW_161766 5071 pH: 7.4; temp: 22.00 C Y Y ECO:0000006 PubMed:10514279 BindingDB AAE 9/1/2014 0 2200003072 curatus P43405 6850 SYK Homo sapiens 9606 Comment/biophysicochemical properties/IC50 1,2,4-Oxadiazole Analogue 5m; IC50: 464000.0 nM; Tyrosine Kinase Syk; 464000 nM 1,2,4-Oxadiazole Analogue 5m CHEBI:NEW_161767 5074 pH: 7.4; temp: 22.00 C Y Y ECO:0000006 PubMed:10514279 BindingDB AAE 9/1/2014 0 2200003073 curatus P43405 6850 SYK Homo sapiens 9606 Comment/biophysicochemical properties/IC50 1,2,4-Oxadiazole Analogue 12g; IC50: 452000.0 nM; Tyrosine Kinase Syk; 452000 nM 1,2,4-Oxadiazole Analogue 12g CHEBI:NEW_161774 5085 pH: 7.4; temp: 22.00 C Y Y ECO:0000006 PubMed:10514279 BindingDB AAE 9/1/2014 0 2200003080 curatus P43405 6850 SYK Homo sapiens 9606 Comment/biophysicochemical properties/IC50 1,2,4-Oxadiazole Analogue 14c; IC50: 397000.0 nM; Tyrosine Kinase Syk; 397000 nM 1,2,4-Oxadiazole Analogue 14c CHEBI:NEW_161775 5088 pH: 7.4; temp: 22.00 C Y Y ECO:0000006 PubMed:10514279 BindingDB AAE 9/1/2014 0 2200003081 curatus P43405 6850 SYK Homo sapiens 9606 Comment/biophysicochemical properties/IC50 1,2,4-Oxadiazole Analogue 14e; IC50: 302000.0 nM; Tyrosine Kinase Syk; 302000 nM 1,2,4-Oxadiazole Analogue 14e CHEBI:NEW_161776 5090 pH: 7.4; temp: 22.00 C Y Y ECO:0000006 PubMed:10514279 BindingDB AAE 9/1/2014 0 2200003082 curatus P43405 6850 SYK Homo sapiens 9606 Comment/biophysicochemical properties/IC50 1,2,4-Oxadiazole Analogue 14f; IC50: 433000.0 nM; Tyrosine Kinase Syk; 433000 nM 1,2,4-Oxadiazole Analogue 14f CHEBI:NEW_161777 5091 pH: 7.4; temp: 22.00 C Y Y ECO:0000006 PubMed:10514279 BindingDB AAE 9/1/2014 0 2200003083 curatus P43405 6850 SYK Homo sapiens 9606 Comment/biophysicochemical properties/IC50 1,2,4-Oxadiazole Analogue 15a; IC50: 318000.0 nM; Tyrosine Kinase Syk; 318000 nM 1,2,4-Oxadiazole Analogue 15a CHEBI:NEW_161779 5104 pH: 7.4; temp: 22.00 C Y Y ECO:0000006 PubMed:10514279 BindingDB AAE 9/1/2014 0 2200003085 curatus P43405 6850 SYK Homo sapiens 9606 Comment/biophysicochemical properties/IC50 1,2,4-Oxadiazole Analogue 13a; IC50: 323000.0 nM; Tyrosine Kinase Syk; 323000 nM 1,2,4-Oxadiazole Analogue 13a CHEBI:NEW_161784 5101 pH: 7.4; temp: 22.00 C Y Y ECO:0000006 PubMed:10514279 BindingDB AAE 9/1/2014 0 2200003090 curatus P43405 6850 SYK Homo sapiens 9606 Comment/biophysicochemical properties/IC50 1,2,4-Oxadiazole Analogue 13b; IC50: 288000.0 nM; Tyrosine Kinase Syk; 288000 nM 1,2,4-Oxadiazole Analogue 13b CHEBI:NEW_161785 5102 pH: 7.4; temp: 22.00 C Y Y ECO:0000006 PubMed:10514279 BindingDB AAE 9/1/2014 0 2200003091 curatus P43405 6850 SYK Homo sapiens 9606 Comment/biophysicochemical properties/IC50 1,2,4-Oxadiazole Analogue 13c; IC50: 250000.0 nM; Tyrosine Kinase Syk; 250000 nM 1,2,4-Oxadiazole Analogue 13c CHEBI:NEW_161786 5103 pH: 7.4; temp: 22.00 C Y Y ECO:0000006 PubMed:10514279 BindingDB AAE 9/1/2014 0 2200003092