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P08631 | HCK_HUMAN | Tyrosine-protein kinase HCK (HCK)

3D structures mapped by conservation among orthologs

[ Domain: "Protein kinase" // Pkinase_Tyr ]

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[ Domain: "SH2" // SH2 ]

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[ Domain: "SH3" // SH3_1 ]

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[ Domain: pdbs with more than 2 multi-domains ]

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[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table Ki table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL1171837 OBDepict H 3 C N N F F F N H O CH 3 N N N IC50 = 0.11 nM 532.57 Cc1ccc(C(=O)Nc2ccc(CN3CCN(C)CC3)c(C(F)(F)F)c2)cc1C#Cc1cnc2cccnn12 Homo sapiens CHEMBL4721778 single protein format
CHEMBL1241676 OBDepict Cl HO N N H 2 N N N IC50 = 0.18 nM 329.79 Nc1ncnc2c1c(-c1ccc(Cl)c(O)c1)nn2C1CCCC1 Homo sapiens CHEMBL1243973 single protein format
CHEMBL4075002 OBDepict H 3 C N CH 3 N H H N N N H 2 N O IC50 = 0.26 nM 510.69 CC(C)N1CCN([C@H]2CC[C@H](n3cc(-c4ccc(Oc5ccccc5)cc4)c4c(N)ncnc43)CC2)CC1 Homo sapiens CHEMBL4056678 single protein format
CHEMBL45177 OBDepict H 3 C N N H H N N N NH 2 O IC50 = 0.43 nM 482.63 CN1CCN([C@H]2CC[C@H](n3cc(-c4ccc(Oc5ccccc5)cc4)c4c(N)ncnc43)CC2)CC1 Homo sapiens CHEMBL4056677 cell-based format
CHEMBL3647967 OBDepict CH 2 HN O H H N N N N H 2 N O IC50 = 1.0 nM 454.53 C=CC(=O)N[C@H]1CC[C@@H](n2nc(-c3ccc(Oc4ccccc4)cc3)c3c(N)ncnc32)CC1 Homo sapiens CHEMBL3887541 single protein format
CHEMBL1241481 OBDepict CH 3 O NH N O O N NH 2 N N H 3 C H 3 C CH 3 H 3 C CH 3 IC50 < 1.0 nM 398.47 COc1cc(-c2nn(C(C)C)c3ncnc(N)c23)ccc1NC(=O)OC(C)(C)C Homo sapiens CHEMBL1243973 single protein format
CHEMBL1421 OBDepict HO N N N N N H CH 3 N S N H O H 3 C Cl IC50 < 1.0 nM 488.02 Cc1nc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)cc(N2CCN(CCO)CC2)n1 Homo sapiens CHEMBL1243973 single protein format
CHEMBL4208645 OBDepict OH N H H O HO H H N N N H 2 N O IC50 = 1.8 nM 487.56 Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2[C@H]1CC[C@H](N[C@@H](CO)C(=O)O)CC1 Homo sapiens CHEMBL4180100 single protein format
CHEMBL388978 OBDepict CH 3 HN H H O H O N H 3 C H 3 C N O N H IC50 = 1.9 nM 466.54 CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 Homo sapiens CHEMBL4328442 single protein format
CHEMBL1241484 OBDepict Cl OH N N H 2 N N N CH 3 H 3 C IC50 = 2.0 nM 303.75 CC(C)n1nc(-c2ccc(Cl)c(O)c2)c2c(N)ncnc21 Homo sapiens CHEMBL1243973 single protein format
CHEMBL1090975 OBDepict O N H HN N N O CH 3 CH 3 CH 3 H 3 C N N N H H O IC50 < 2.0 nM 547.62 Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)[nH]c34)c3ccccc23)cc1 Homo sapiens CHEMBL3707675 single protein format
CHEMBL3695582 OBDepict CH 3 O N N NH H 3 C CH 3 H 3 C NH O O N N H N O H IC50 < 2.0 nM 563.62 COc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)[nH]c34)c3ccccc23)cc1 Homo sapiens CHEMBL3707675 single protein format
CHEMBL3695571 OBDepict CH 3 O N N NH H 3 C CH 3 H 3 C NH O N O N N H N O H IC50 < 2.0 nM 564.61 COc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)[nH]c34)c3ncccc23)cc1 Homo sapiens CHEMBL3707675 single protein format
CHEMBL364623 OBDepict CH 3 N N H N H 3 C N S N H O H 3 C Cl IC50 = 2.0 nM 373.87 Cc1cc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)nc(C)n1 Homo sapiens CHEMBL828514 single protein format
CHEMBL1241581 OBDepict CH 3 O NH 2 N N NH 2 N N IC50 = 2.0 nM 324.39 COc1cc(-c2nn(C3CCCC3)c3ncnc(N)c23)ccc1N Homo sapiens CHEMBL1243973 single protein format
CHEMBL1090979 OBDepict O N H NH N N O H 3 C H 3 C H 3 C CH 3 N N CH 3 N O H IC50 = 2.0 nM 561.65 Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)n(C)c34)c3ccccc23)cc1 Homo sapiens CHEMBL3707675 single protein format
CHEMBL1093756 OBDepict O HN N H N N CH 3 CH 3 H 3 C O N N H N O H IC50 < 2.0 nM 533.59 CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)[nH]c34)c3ccccc23)n(-c2ccccc2)n1 Homo sapiens CHEMBL3707675 single protein format
CHEMBL4568087 OBDepict H 3 C N N N N N S N H O H H H 2 N IC50 = 2.8 nM 421.53 Cn1cc(-c2cnc3c(-c4csc(C(=O)N[C@@H]5CCCC[C@@H]5N)c4)cnn3c2)cn1 Homo sapiens CHEMBL4479726 assay format
CHEMBL3695593 OBDepict O N H NH N N S CH 3 CH 3 H 3 C O CH 3 N N N H O IC50 = 3.0 nM 565.66 Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)s1 Homo sapiens CHEMBL3707675 single protein format
CHEMBL1214131 OBDepict O N H HN N N CH 3 CH 3 H 3 C O N N N H O IC50 = 3.0 nM 545.6 CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)n(-c2ccccc2)n1 Homo sapiens CHEMBL3707675 single protein format
CHEMBL3695583 OBDepict CH 3 O N N NH H 3 C CH 3 H 3 C NH O O N N N CH 3 H O IC50 = 3.0 nM 577.65 COc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)n(C)c34)c3ccccc23)cc1 Homo sapiens CHEMBL3707675 single protein format
CHEMBL1214132 OBDepict O NH NH N N H 3 C H 3 C CH 3 O N N N CH 3 H O IC50 = 3.0 nM 559.63 Cc1nc2c(Oc3ccc(NC(=O)Nc4cc(C(C)(C)C)nn4-c4ccccc4)c4ccccc34)ccnc2[nH]c1=O Homo sapiens CHEMBL3707675 single protein format
CHEMBL3695592 OBDepict OH N N N NH H 3 C CH 3 H 3 C NH O O N N N H O IC50 = 3.0 nM 576.62 CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)n(-c2ccc(CO)nc2)n1 Homo sapiens CHEMBL3707675 single protein format
CHEMBL4798527 OBDepict H 3 C N H N O N NH 2 N N H CH 3 F F F H HO IC50 = 3.0 nM 548.57 Cc1ccc(NC(=O)c2ccc(C)c(C(F)(F)F)c2)cc1C#Cc1nn([C@H]2CC[C@H](O)CC2)c2ncnc(N)c12 Homo sapiens CHEMBL4766144 single protein format
CHEMBL1214134 OBDepict O HN N H N N CH 3 CH 3 CH 3 O H 3 C N N N H O IC50 = 3.0 nM 559.63 Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)cc1 Homo sapiens CHEMBL3707675 single protein format
CHEMBL4515441 OBDepict CH 2 N H O NH N N N H N H O H 3 C Cl N N H 3 C IC50 = 3.0 nM 597.12 C=CC(=O)Nc1ccccc1Nc1nc(Nc2ccc(N3CCN(C)CC3)cc2)ncc1C(=O)Nc1c(C)cccc1Cl Homo sapiens CHEMBL4358198 single protein format
CHEMBL3695569 OBDepict CH 3 O HN O N O N H N H O N N CH 3 CH 3 H 3 C H 3 C IC50 = 3.0 nM 578.67 COCC(=O)Nc1cc(Oc2ccc(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccc(C)cc3)c3ccccc23)ccn1 Homo sapiens CHEMBL3707675 single protein format
CHEMBL288441 OBDepict CH 3 O O N N H N N Cl O H 3 C Cl N CH 3 IC50 = 3.2 nM 530.46 COc1cc(Nc2c(C#N)cnc3cc(OCCCN4CCN(C)CC4)c(OC)cc23)c(Cl)cc1Cl Homo sapiens CHEMBL1244332 single protein format
CHEMBL4095434 OBDepict HO N N H H N N N H 2 N O IC50 = 3.5 nM 512.66 Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2[C@H]1CC[C@H](N2CCN(CCO)CC2)CC1 Homo sapiens CHEMBL4056678 single protein format
CHEMBL1873475 OBDepict CH 2 N O H N N N N H 2 N O IC50 = 3.7 nM 440.51 C=CC(=O)N1CCC[C@@H](n2nc(-c3ccc(Oc4ccccc4)cc3)c3c(N)ncnc32)C1 Homo sapiens CHEMBL3887541 single protein format
CHEMBL3695586 OBDepict CH 3 O N N NH H 3 C CH 3 H 3 C NH O Cl Cl O N N N CH 3 H O IC50 = 4.0 nM 596.48 COc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)n(C)c34)c(Cl)c2Cl)cc1 Homo sapiens CHEMBL3707675 single protein format
CHEMBL3695581 OBDepict CH 3 S N N NH H 3 C CH 3 H 3 C NH O O N N N H O IC50 = 4.0 nM 591.7 CSc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)cc1 Homo sapiens CHEMBL3707675 single protein format
CHEMBL3695577 OBDepict O NH N H N N CH 3 O CH 3 N N N H O IC50 = 4.0 nM 557.61 Cc1ccc(-n2nc(C3(C)CC3)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)cc1 Homo sapiens CHEMBL3707675 single protein format
CHEMBL3695591 OBDepict OH N N NH H 3 C CH 3 H 3 C NH O Cl Cl O N N N H O IC50 = 4.0 nM 594.46 CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c(Cl)c2Cl)n(-c2ccc(CO)cc2)n1 Homo sapiens CHEMBL3707675 single protein format
CHEMBL1241578 OBDepict Br OH N N H 2 N N N CH 3 H 3 C IC50 = 4.0 nM 348.2 CC(C)n1nc(-c2ccc(Br)c(O)c2)c2c(N)ncnc21 Homo sapiens CHEMBL1243973 single protein format
CHEMBL3695578 OBDepict O HN N H N N CH 3 CH 3 O H 3 C N N N H O IC50 = 4.0 nM 545.6 Cc1ccc(-n2nc(C(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)cc1 Homo sapiens CHEMBL3707675 single protein format
CHEMBL4066401 OBDepict OH O N H H H N N N H 2 N O IC50 = 4.2 nM 457.53 Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2[C@H]1CC[C@H](NCC(=O)O)CC1 Homo sapiens CHEMBL4056678 single protein format
CHEMBL1242199 OBDepict HO F N N H 2 N N N IC50 = 4.4 nM 313.34 Nc1ncnc2c1c(-c1cc(O)cc(F)c1)nn2C1CCCC1 Homo sapiens CHEMBL1243973 single protein format
CHEMBL2336005 OBDepict OH NH S N N O IC50 = 4.4 nM 417.53 Oc1cccc(Nc2ccnc3cc(-c4cccc(CN5CCOCC5)c4)sc23)c1 Homo sapiens CHEMBL3707629 cell membrane format
CHEMBL1242568 OBDepict F HO N N H 2 N N N IC50 = 4.5 nM 313.34 Nc1ncnc2c1c(-c1ccc(F)c(O)c1)nn2C1CCCC1 Homo sapiens CHEMBL1243973 single protein format
CHEMBL3695572 OBDepict CH 3 O N N N NH H 3 C CH 3 H 3 C NH O O N N N CH 3 H O IC50 = 5.0 nM 578.63 COc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)n(C)c34)c3ccccc23)cn1 Homo sapiens CHEMBL3707675 single protein format
CHEMBL1214135 OBDepict O HN N H N N CH 3 CH 3 CH 3 O H 3 C N N N H 3 C H O IC50 = 5.0 nM 573.66 Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)c(C)nc34)c3ccccc23)cc1 Homo sapiens CHEMBL3707675 single protein format
CHEMBL3695584 OBDepict H 3 C O N N HN CH 3 CH 3 H 3 C N H O O N N N H CH 3 O IC50 = 5.0 nM 591.67 CCn1c(=O)[nH]c2nccc(Oc3ccc(NC(=O)Nc4cc(C(C)(C)C)nn4-c4ccc(OC)cc4)c4ccccc34)c21 Homo sapiens CHEMBL3707675 single protein format
CHEMBL1242664 OBDepict H 2 N N N N N N H IC50 = 5.0 nM 318.38 Nc1ncnc2c1c(-c1ccc3cc[nH]c3c1)nn2C1CCCC1 Homo sapiens CHEMBL1243973 single protein format
CHEMBL406845 OBDepict Cl N N H 2 N N N H 3 C H 3 C CH 3 IC50 = 5.0 nM 301.78 CC(C)(C)n1nc(-c2ccc(Cl)cc2)c2c(N)ncnc21 Homo sapiens CHEMBL936934 single protein format
CHEMBL1242026 OBDepict CH 3 OH N N NH 2 N N H 3 C CH 3 IC50 = 5.1 nM 283.34 Cc1ccc(-c2nn(C(C)C)c3ncnc(N)c23)cc1O Homo sapiens CHEMBL1243973 single protein format
CHEMBL1242295 OBDepict H 2 N N N N N N H IC50 = 5.4 nM 318.38 Nc1ncnc2c1c(-c1ccc3[nH]ccc3c1)nn2C1CCCC1 Homo sapiens CHEMBL1243973 single protein format
CHEMBL4207885 OBDepict O O H N H H H N N N H 2 N O IC50 = 5.4 nM 483.57 Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2[C@H]1CC[C@@H](N[C@H]2CCOC2=O)CC1 Homo sapiens CHEMBL4180100 single protein format
CHEMBL1242656 OBDepict H 3 C N N N N NH 2 OH F IC50 = 5.7 nM 327.36 CC1CCC(n2nc(-c3ccc(F)c(O)c3)c3c(N)ncnc32)C1 Homo sapiens CHEMBL1243973 single protein format
CHEMBL1241580 OBDepict Cl OH N N NH 2 N N IC50 = 5.8 nM 315.76 Nc1ncnc2c1c(-c1ccc(Cl)c(O)c1)nn2C1CCC1 Homo sapiens CHEMBL1243973 single protein format
CHEMBL4215201 OBDepict OH N H H O HO H H N N N H 2 N O IC50 = 6.3 nM 487.56 Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2[C@H]1CC[C@H](N[C@H](CO)C(=O)O)CC1 Homo sapiens CHEMBL4180100 single protein format
CHEMBL4206460 OBDepict HO O HN CH 3 H H H N N N H 2 N O IC50 = 6.9 nM 471.56 C[C@H](N[C@H]1CC[C@H](n2cc(-c3ccc(Oc4ccccc4)cc3)c3c(N)ncnc32)CC1)C(=O)O Homo sapiens CHEMBL4180100 single protein format
CHEMBL3695570 OBDepict O HN N H N N N CH 3 CH 3 H 3 C O N N H N O H IC50 = 7.0 nM 534.58 CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)[nH]c34)c3ncccc23)n(-c2ccccc2)n1 Homo sapiens CHEMBL3707675 single protein format
CHEMBL4209781 OBDepict OH O N H H H H N HO N N NH 2 O IC50 = 7.4 nM 563.66 Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2[C@H]1CC[C@H](N[C@@H](Cc2ccc(O)cc2)C(=O)O)CC1 Homo sapiens CHEMBL4180100 single protein format
CHEMBL4216163 OBDepict H 2 N N N N H O H HN H O OH IC50 = 7.5 nM 547.66 Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2[C@H]1CC[C@H](N[C@@H](Cc2ccccc2)C(=O)O)CC1 Homo sapiens CHEMBL4180100 single protein format
CHEMBL4087733 OBDepict H 2 N O NH H H N N N NH 2 O IC50 = 7.6 nM 456.55 NC(=O)CN[C@H]1CC[C@H](n2cc(-c3ccc(Oc4ccccc4)cc3)c3c(N)ncnc32)CC1 Homo sapiens CHEMBL4056678 single protein format
CHEMBL1083023 OBDepict CH 3 N N N N N H 2 N HO IC50 = 8.0 nM 400.49 CN1CCN(c2ccc(-c3cnn4c(N)c(-c5cccc(O)c5)cnc34)cc2)CC1 Homo sapiens CHEMBL1120229 single protein format
CHEMBL1081312 OBDepict H 2 N N N N N N N H IC50 = 8.0 nM 319.37 Nc1ncnc2c1c(-c1cnc3[nH]ccc3c1)nn2C1CCCC1 Homo sapiens CHEMBL1243973 single protein format
CHEMBL1241768 OBDepict Cl OH N N H 2 N N N H O IC50 = 8.0 nM 331.76 Nc1ncnc2c1c(-c1ccc(Cl)c(O)c1)nn2[C@@H]1CCOC1 Homo sapiens CHEMBL1243973 single protein format
CHEMBL1241678 OBDepict Cl OH N N H 2 N N N H O IC50 = 8.8 nM 331.76 Nc1ncnc2c1c(-c1ccc(Cl)c(O)c1)nn2[C@H]1CCOC1 Homo sapiens CHEMBL1243973 single protein format
CHEMBL1242287 OBDepict Br OH N N NH 2 N N IC50 = 8.9 nM 360.22 Nc1ncnc2c1c(-c1ccc(Br)c(O)c1)nn2C1CCC1 Homo sapiens CHEMBL1243973 single protein format
CHEMBL1076433 OBDepict CH 3 N N Cl HN O N H CH 3 N N N N H 2 N IC50 = 9.0 nM 596.14 CCN1CCN(Cc2ccc(C(=O)Nc3ccc(C)c(Nc4nc5ccccc5n4-c4cc(N)ncn4)c3)cc2Cl)CC1 Homo sapiens CHEMBL1113976 single protein format
CHEMBL3695576 OBDepict O NH N H N N O CH 3 N N N H O IC50 = 9.0 nM 543.59 Cc1ccc(-n2nc(C3CC3)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)cc1 Homo sapiens CHEMBL3707675 single protein format
CHEMBL4071932 OBDepict H 2 N N N N H O H N H N IC50 = 9.0 nM 490.61 Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2[C@H]1CC[C@H](NCc2ccncc2)CC1 Homo sapiens CHEMBL4056678 single protein format
CHEMBL4862806 OBDepict CH 3 N N N H 2 N CH 3 NH O F F F F F F IC50 = 9.0 nM 543.47 Cc1ccc(C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1C#Cc1cc(-c2cnn(C)c2)cnc1N Homo sapiens CHEMBL4839490 single protein format
CHEMBL1242852 OBDepict H 2 N N N N N CH 3 H 3 C N O O H 3 C H 3 C CH 3 IC50 = 9.0 nM 392.46 CC(C)n1nc(-c2ccc3c(ccn3C(=O)OC(C)(C)C)c2)c2c(N)ncnc21 Homo sapiens CHEMBL1243973 single protein format
CHEMBL1242377 OBDepict F OH N N H 2 N N N CH 3 H 3 C IC50 = 9.2 nM 287.3 CC(C)n1nc(-c2ccc(F)c(O)c2)c2c(N)ncnc21 Homo sapiens CHEMBL1243973 single protein format
CHEMBL1242285 OBDepict HO Br N N H 2 N N N CH 3 H 3 C IC50 = 10.0 nM 348.2 CC(C)n1nc(-c2cc(O)cc(Br)c2)c2c(N)ncnc21 Homo sapiens CHEMBL1243973 single protein format
CHEMBL1242293 OBDepict H 2 N N N N N N CH 3 H 3 C N H IC50 = 10.0 nM 293.33 CC(C)n1nc(-c2cnc3[nH]ccc3c2)c2c(N)ncnc21 Homo sapiens CHEMBL1243973 single protein format
CHEMBL1242202 OBDepict CH 3 O OH N N NH 2 N N H 3 C IC50 = 10.0 nM 339.4 COc1ccc(-c2nn(C3CCC(C)C3)c3ncnc(N)c23)cc1O Homo sapiens CHEMBL1243973 single protein format
CHEMBL1075628 OBDepict CH 3 N N N N H 3 C H 3 C CH 3 N H O N H H 3 C N N N N H 2 N IC50 = 11.0 nM 593.74 Cc1ccc(NC(=O)c2cc(CN3CCN(C)CC3)n(C(C)(C)C)n2)cc1Nc1nc2ccccc2n1-c1cc(N)ncn1 Homo sapiens CHEMBL1113976 single protein format
CHEMBL1242566 OBDepict F OH N N NH 2 N N IC50 = 11.0 nM 299.31 Nc1ncnc2c1c(-c1ccc(F)c(O)c1)nn2C1CCC1 Homo sapiens CHEMBL1243973 single protein format
CHEMBL4093003 OBDepict CH 3 CH 3 NH H O HO H H N N N NH 2 O IC50 = 11.0 nM 513.64 CC(C)C[C@H](N[C@H]1CC[C@H](n2cc(-c3ccc(Oc4ccccc4)cc3)c3c(N)ncnc32)CC1)C(=O)O Homo sapiens CHEMBL4056676 cell-based format
CHEMBL1242376 OBDepict Br HO N N H 2 N N N IC50 = 12.0 nM 374.24 Nc1ncnc2c1c(-c1ccc(Br)c(O)c1)nn2C1CCCC1 Homo sapiens CHEMBL1243973 single protein format
CHEMBL4202763 OBDepict HO O N H H H N N N NH 2 O IC50 = 12.0 nM 457.53 Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2[C@H]1CC[C@@H](NCC(=O)O)CC1 Homo sapiens CHEMBL4180100 single protein format
CHEMBL4218162 OBDepict HO O N H H H H N OH N N H 2 N O IC50 = 13.0 nM 563.66 Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2[C@H]1CC[C@@H](N[C@H](Cc2ccc(O)cc2)C(=O)O)CC1 Homo sapiens CHEMBL4180100 single protein format
CHEMBL1241487 OBDepict NH 2 OH N N NH 2 N N IC50 = 13.0 nM 310.36 Nc1ccc(-c2nn(C3CCCC3)c3ncnc(N)c23)cc1O Homo sapiens CHEMBL1243973 single protein format
CHEMBL4061078 OBDepict O HN H N H H H N N N NH 2 O IC50 = 13.5 nM 482.59 Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2[C@H]1CC[C@H](N[C@H]2CCNC2=O)CC1 Homo sapiens CHEMBL4056678 single protein format
CHEMBL1083001 OBDepict CH 3 N N N N N H 2 N N H O IC50 = 14.0 nM 523.69 CN1CCN(c2ccc(-c3cnn4c(N)c(-c5ccc(NC(=O)CCC6CCCC6)cc5)cnc34)cc2)CC1 Homo sapiens CHEMBL1120229 single protein format
CHEMBL1242294 OBDepict H 2 N N N N N CH 3 H 3 C N H IC50 = 15.0 nM 292.35 CC(C)n1nc(-c2ccc3[nH]ccc3c2)c2c(N)ncnc21 Homo sapiens CHEMBL1243973 single protein format
CHEMBL4203665 OBDepict OH O N H H H N N N H 2 N O IC50 = 15.0 nM 471.56 Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2[C@H]1CC[C@H](NCCC(=O)O)CC1 Homo sapiens CHEMBL4180100 single protein format
CHEMBL4213227 OBDepict OH O N H H H H N HO N N NH 2 O IC50 = 15.0 nM 563.66 Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2[C@H]1CC[C@H](N[C@H](Cc2ccc(O)cc2)C(=O)O)CC1 Homo sapiens CHEMBL4180100 single protein format
CHEMBL1163016 OBDepict OH HN N N N N H O CH 3 CH 3 N H 3 C H 3 C . O IC50 = 16.0 nM 499.6 CC1(C)CC(NC(=O)c2cccc(-c3cc4nccc(Nc5cccc(O)c5)n4n3)c2)CC(C)(C)N1[O] Homo sapiens CHEMBL1046246 single protein format
CHEMBL4210294 OBDepict H 2 N N N N H O H HN H O OH IC50 = 18.0 nM 547.66 Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2[C@H]1CC[C@@H](N[C@H](Cc2ccccc2)C(=O)O)CC1 Homo sapiens CHEMBL4180100 single protein format
CHEMBL3695588 OBDepict O N H NH N N H 3 C H 3 C CH 3 O OH N N N H O IC50 = 18.0 nM 561.6 CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)n(-c2ccc(O)cc2)n1 Homo sapiens CHEMBL3707675 single protein format
CHEMBL1242114 OBDepict CH 3 O OH N N NH 2 N N H 3 C CH 3 IC50 = 18.0 nM 299.33 COc1ccc(-c2nn(C(C)C)c3ncnc(N)c23)cc1O Homo sapiens CHEMBL1243973 single protein format
CHEMBL1242574 OBDepict H 2 N N N N N CH 3 H 3 C N H IC50 = 18.0 nM 292.35 CC(C)n1nc(-c2ccc3cc[nH]c3c2)c2c(N)ncnc21 Homo sapiens CHEMBL1243973 single protein format
CHEMBL1242201 OBDepict CH 3 O OH N N NH 2 N N IC50 = 18.0 nM 325.37 COc1ccc(-c2nn(C3CCCC3)c3ncnc(N)c23)cc1O Homo sapiens CHEMBL1243973 single protein format
CHEMBL1242109 OBDepict H 3 C N CH 3 N N N NH 2 OH CH 3 IC50 = 19.0 nM 297.36 CCC(C)n1nc(-c2ccc(C)c(O)c2)c2c(N)ncnc21 Homo sapiens CHEMBL1243973 single protein format
CHEMBL1242662 OBDepict HO N N H 2 N N N CH 3 H 3 C IC50 = 20.0 nM 319.37 CC(C)n1nc(-c2ccc3cc(O)ccc3c2)c2c(N)ncnc21 Homo sapiens CHEMBL1243973 single protein format
CHEMBL1241677 OBDepict Cl OH N N H 2 N N N H N H IC50 = 20.0 nM 330.78 Nc1ncnc2c1c(-c1ccc(Cl)c(O)c1)nn2[C@@H]1CCNC1 Homo sapiens CHEMBL1243973 single protein format
CHEMBL1242748 OBDepict F OH N N H 2 N N N H O IC50 = 21.0 nM 315.31 Nc1ncnc2c1c(-c1ccc(F)c(O)c1)nn2[C@H]1CCOC1 Homo sapiens CHEMBL1243973 single protein format
CHEMBL1084234 OBDepict CH 3 N N N N N H 2 N N H N H O IC50 = 21.0 nM 538.7 CN1CCN(c2ccc(-c3cnn4c(N)c(-c5ccc(NC(=O)NCC6CCCCC6)cc5)cnc34)cc2)CC1 Homo sapiens CHEMBL1120229 single protein format
CHEMBL3695594 OBDepict CH 3 O N N N H CH 3 CH 3 H 3 C N H O O N N N H O IC50 = 22.0 nM 589.66 COc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(OCc3ccnc4[nH]c(=O)cnc34)c3ccccc23)cc1 Homo sapiens CHEMBL3707675 single protein format
CHEMBL3808884 OBDepict CH 3 O O N H N N H CH 3 N H O N F F F N H 3 C IC50 = 22.0 nM 562.55 COC(=O)c1cc2cc(NCc3cc(NC(=O)c4cc(-n5cnc(C)c5)cc(C(F)(F)F)c4)ccc3C)cnc2[nH]1 Homo sapiens CHEMBL3811754 assay format
CHEMBL4203527 OBDepict HO N H H O OH H H N N N NH 2 O IC50 = 23.0 nM 487.56 Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2[C@H]1CC[C@@H](N[C@H](CO)C(=O)O)CC1 Homo sapiens CHEMBL4180100 single protein format
CHEMBL1230790 OBDepict HO N N H 2 N N N CH 3 H 3 C IC50 = 23.0 nM 269.31 CC(C)n1nc(-c2cccc(O)c2)c2c(N)ncnc21 Homo sapiens CHEMBL1243973 single protein format
CHEMBL1242024 OBDepict OH CH 3 N N NH 2 N N H 3 C CH 3 IC50 = 23.0 nM 283.34 Cc1cc(O)ccc1-c1nn(C(C)C)c2ncnc(N)c12 Homo sapiens CHEMBL1243973 single protein format
CHEMBL3695589 OBDepict OH N N NH H 3 C CH 3 H 3 C NH O O N N N H O IC50 = 24.0 nM 575.63 CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)n(-c2ccc(CO)cc2)n1 Homo sapiens CHEMBL3707675 single protein format
CHEMBL4205400 OBDepict H 2 N N N N H O H HN H O OH IC50 = 24.0 nM 547.66 Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2[C@H]1CC[C@H](N[C@H](Cc2ccccc2)C(=O)O)CC1 Homo sapiens CHEMBL4180100 single protein format