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P53778 | MK12_HUMAN | Mitogen-activated protein kinase 12 (MAPK12)

3D structures mapped by conservation among orthologs

[ Domain: "Protein kinase" // Pkinase_Tyr ]

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[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL4855542 OBDepict NH 2 N S N O NH IC50 = -43700.0 nM 372.45 Nc1ncc(-c2cccc3ncsc23)cc1-c1ccc2c(c1)CCNC2=O Homo sapiens CHEMBL4804455 cell-based format
CHEMBL4859660 OBDepict NH 2 N F + N O NH O _ O IC50 = -11000.0 nM 378.36 Nc1ncc(-c2cccc([N+](=O)[O-])c2F)cc1-c1ccc2c(c1)CCNC2=O Homo sapiens CHEMBL4804455 cell-based format
CHEMBL4868141 OBDepict H 2 N N O O HN NH S O O IC50 = -8500.0 nM 532.67 Nc1ncc(-c2ccc(NS(=O)(=O)C3CC3)cc2OC2CCCCC2)cc1-c1ccc2c(c1)CCNC2=O Homo sapiens CHEMBL4804455 cell-based format
CHEMBL3695577 OBDepict O NH N H N N CH 3 O CH 3 N N N H O IC50 = 19.0 nM 557.61 Cc1ccc(-n2nc(C3(C)CC3)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)cc1 Homo sapiens CHEMBL3707643 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 = 23.0 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 CHEMBL3707643 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 = 24.0 nM 561.65 Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)n(C)c34)c3ccccc23)cc1 Homo sapiens CHEMBL3707643 single protein format
CHEMBL103667 OBDepict O HN N H N N CH 3 CH 3 CH 3 O H 3 C N O IC50 = 30.0 nM 527.67 Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(OCCN3CCOCC3)c3ccccc23)cc1 Homo sapiens CHEMBL1931522 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 = 35.0 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 CHEMBL3707643 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 = 39.0 nM 545.6 Cc1ccc(-n2nc(C(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)cc1 Homo sapiens CHEMBL3707643 single protein 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 = 41.0 nM 565.66 Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)s1 Homo sapiens CHEMBL3707643 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 = 43.0 nM 545.6 CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)n(-c2ccccc2)n1 Homo sapiens CHEMBL3707643 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 = 44.0 nM 576.62 CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)n(-c2ccc(CO)nc2)n1 Homo sapiens CHEMBL3707643 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 = 45.0 nM 561.6 CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)n(-c2ccc(O)cc2)n1 Homo sapiens CHEMBL3707643 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 = 45.0 nM 577.65 COc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)n(C)c34)c3ccccc23)cc1 Homo sapiens CHEMBL3707643 single protein format
CHEMBL3695573 OBDepict CH 3 O N N NH H 3 C CH 3 H 3 C NH O O N N N H O IC50 = 50.0 nM 575.63 COc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)cc1 Homo sapiens CHEMBL3707643 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 = 67.0 nM 533.59 CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)[nH]c34)c3ccccc23)n(-c2ccccc2)n1 Homo sapiens CHEMBL3707643 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 = 72.0 nM 559.63 Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)cc1 Homo sapiens CHEMBL3707643 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 = 74.0 nM 547.62 Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)[nH]c34)c3ccccc23)cc1 Homo sapiens CHEMBL3707643 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 = 74.0 nM 591.7 CSc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)cc1 Homo sapiens CHEMBL3707643 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 = 99.0 nM 573.66 Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)c(C)nc34)c3ccccc23)cc1 Homo sapiens CHEMBL3707643 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 = 100.0 nM 559.63 Cc1nc2c(Oc3ccc(NC(=O)Nc4cc(C(C)(C)C)nn4-c4ccccc4)c4ccccc34)ccnc2[nH]c1=O Homo sapiens CHEMBL3707643 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 = 119.0 nM 563.62 COc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)[nH]c34)c3ccccc23)cc1 Homo sapiens CHEMBL3707643 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 = 126.0 nM 578.63 COc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)n(C)c34)c3ccccc23)cn1 Homo sapiens CHEMBL3707643 single protein format
CHEMBL3972318 OBDepict O HN HN N N CH 3 CH 3 H 3 C O H 3 C N N H O CH 3 IC50 = 146.0 nM 548.65 CC(=O)Nc1cc(Oc2ccc(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccc(C)cc3)c3ccccc23)ccn1 Homo sapiens CHEMBL3887972 single protein format
CHEMBL3781687 OBDepict CH 3 HN HN O N O N H N H O N N CH 3 CH 3 H 3 C H 3 C IC50 = 169.0 nM 591.72 CNC(=O)Nc1cc(CCOc2ccc(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccc(C)cc3)c3ccccc23)ccn1 Homo sapiens CHEMBL3783187 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 = 180.0 nM 564.61 COc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)[nH]c34)c3ncccc23)cc1 Homo sapiens CHEMBL3707643 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 = 193.0 nM 589.66 COc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(OCc3ccnc4[nH]c(=O)cnc34)c3ccccc23)cc1 Homo sapiens CHEMBL3707643 single protein format
CHEMBL3781102 OBDepict O HN HN N N CH 3 CH 3 H 3 C O H 3 C N N H O CH 3 IC50 = 195.0 nM 562.67 CC(=O)Nc1cc(COc2ccc(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccc(C)cc3)c3ccccc23)ccn1 Homo sapiens CHEMBL3783187 single protein format
CHEMBL4793380 OBDepict O NH N H N O H 3 C H 3 C CH 3 N H N O N HN IC50 = 199.0 nM 423.48 CC(C)(C)c1cc(NC(=O)Nc2ccc(Nc3ncnc4c3OCCCN4)cc2)no1 Homo sapiens CHEMBL4767037 single protein format
CHEMBL143134 OBDepict O HN N H N N CH 3 CH 3 CH 3 O H 3 C N IC50 = 213.0 nM 519.65 Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(OCCc3ccncc3)c3ccccc23)cc1 Homo sapiens CHEMBL3783187 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 = 214.0 nM 534.58 CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)[nH]c34)c3ncccc23)n(-c2ccccc2)n1 Homo sapiens CHEMBL3707643 single protein format
CHEMBL3695575 OBDepict O N H NH N N H 3 C H 3 C CH 3 O Cl N N N H O IC50 = 237.0 nM 580.05 CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)n(-c2ccc(Cl)cc2)n1 Homo sapiens CHEMBL3707643 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 = 275.0 nM 466.54 CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 Homo sapiens CHEMBL4328538 single protein format
CHEMBL3780714 OBDepict O HN N H N N CH 3 H 3 C CH 3 O H 3 C N N H S O O CH 3 IC50 = 303.0 nM 598.73 Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(OCc3ccnc(NS(C)(=O)=O)c3)c3ccccc23)cc1 Homo sapiens CHEMBL3783187 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 = 318.0 nM 575.63 CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)c3ccccc23)n(-c2ccc(CO)cc2)n1 Homo sapiens CHEMBL3707643 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 = 344.0 nM 578.67 COCC(=O)Nc1cc(Oc2ccc(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccc(C)cc3)c3ccccc23)ccn1 Homo sapiens CHEMBL3707643 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 = 348.0 nM 591.67 CCn1c(=O)[nH]c2nccc(Oc3ccc(NC(=O)Nc4cc(C(C)(C)C)nn4-c4ccc(OC)cc4)c4ccccc34)c21 Homo sapiens CHEMBL3707643 single protein format
CHEMBL3695568 OBDepict CH 3 O N H O N O N H N H O N N CH 3 CH 3 H 3 C H 3 C IC50 = 402.0 nM 592.7 COCC(=O)Nc1cc(COc2ccc(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccc(C)cc3)c3ccccc23)ccn1 Homo sapiens CHEMBL3707643 single protein format
CHEMBL3695587 OBDepict O HN N H N N CH 3 CH 3 CH 3 O H 3 C N N N H N O H IC50 = 539.0 nM 548.61 Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ncnc4[nH]c(=O)[nH]c34)c3ccccc23)cc1 Homo sapiens CHEMBL3707643 single protein format
CHEMBL3780111 OBDepict O NH N H N N H 3 C H 3 C H 3 C O CH 3 H 2 N N IC50 = 591.0 nM 534.66 Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(OCCc3ccncc3N)c3ccccc23)cc1 Homo sapiens CHEMBL3783187 single protein format
CHEMBL343227 OBDepict O HN N H N N CH 3 CH 3 CH 3 O H 3 C N IC50 = 616.0 nM 519.65 Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(OCCc3cccnc3)c3ccccc23)cc1 Homo sapiens CHEMBL3783187 single protein format
CHEMBL3780488 OBDepict O HN HN N N O CH 3 CH 3 H 3 C H 3 C HN N O CH 3 IC50 = 634.0 nM 576.7 CC(=O)Nc1cnccc1CCOc1ccc(NC(=O)Nc2cc(C(C)(C)C)nn2-c2ccc(C)cc2)c2ccccc12 Homo sapiens CHEMBL3783187 single protein format
CHEMBL3781430 OBDepict O NH NH N N H 3 C H 3 C CH 3 O CH 3 N N H O H 3 C IC50 = 972.0 nM 576.7 CC(=O)Nc1cc(CCOc2ccc(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccc(C)cc3)c3ccccc23)ccn1 Homo sapiens CHEMBL3783187 single protein format