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O14976 | GAK_HUMAN | Cyclin-G-associated kinase (GAK)

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 Ki table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL4531690 OBDepict Cl O N N N O N H IC50 = 0.06 nM 330.78 Clc1cc2cc(c1)-c1cnn3ccc(nc13)NCCOCCO2 Homo sapiens CHEMBL4481510 cell-based format
CHEMBL4797973 OBDepict CH 3 O O CH 3 O H 3 C N N Ki = 1.5 nM 372.42 COc1cc(-c2cnc3cc(-c4ccncc4)ccc3c2)cc(OC)c1OC Homo sapiens CHEMBL4667723 single protein format
CHEMBL4740761 OBDepict H 3 C O H 2 N N N S N H N O IC50 = 2.2 nM 445.55 COc1cc(-c2cnc3c(-c4cccc(NC(=O)N5CCCC5)c4)snc3c2)ccc1N Homo sapiens CHEMBL4736826 single protein format
CHEMBL81073 OBDepict CH 3 O O N H 3 C N H N O O H 3 C O H 3 C CH 3 IC50 = 2.4 nM 395.42 COc1cc2ncc(C#N)c(Nc3cc(OC)c(OC)c(OC)c3)c2cc1OC Homo sapiens CHEMBL4394509 cell-based format
CHEMBL4443342 OBDepict H 3 C O O N H CH 3 O CH 3 N Br Ki = 3.1 nM 389.25 COc1cc(Nc2ccnc3ccc(Br)cc23)cc(OC)c1OC Homo sapiens CHEMBL4481506 assay format
CHEMBL4778276 OBDepict CH 3 O NH 2 N N S N H N O O IC50 = 3.2 nM 461.55 COc1cc(-c2cnc3c(-c4cccc(NC(=O)N5CCOCC5)c4)snc3c2)ccc1N Homo sapiens CHEMBL4736826 single protein format
CHEMBL4531690 OBDepict Cl O N N N O N H Ki = 3.8 nM 330.78 Clc1cc2cc(c1)-c1cnn3ccc(nc13)NCCOCCO2 Homo sapiens CHEMBL4481506 assay format
CHEMBL4762694 OBDepict CH 3 O NH 2 N N S N H O CH 3 H 3 C IC50 = 3.8 nM 418.52 COc1cc(-c2cnc3c(-c4cccc(NC(=O)C(C)C)c4)snc3c2)ccc1N Homo sapiens CHEMBL4736826 single protein format
CHEMBL4764705 OBDepict CH 3 N H O S N N O H 2 N CH 3 IC50 = 7.7 nM 404.5 CCC(=O)Nc1cccc(-c2snc3cc(-c4ccc(N)c(OC)c4)cnc23)c1 Homo sapiens CHEMBL4736826 single protein format
CHEMBL4794323 OBDepict H 3 C O NH 2 N N S N H O IC50 = 8.8 nM 416.51 COc1cc(-c2cnc3c(-c4cccc(NC(=O)C5CC5)c4)snc3c2)ccc1N Homo sapiens CHEMBL4736826 single protein format
CHEMBL1738797 OBDepict CH 3 N O CH 3 H 3 C N N H O N IC50 < 10.0 nM 482.63 CCc1cc2c(cc1N1CCC(N3CCOCC3)CC1)C(C)(C)c1[nH]c3cc(C#N)ccc3c1C2=O Homo sapiens CHEMBL4705535 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 = 11.0 nM 466.54 CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 Homo sapiens CHEMBL4736826 single protein format
CHEMBL4745919 OBDepict CH 2 N H O S N N O H 2 N CH 3 IC50 = 12.0 nM 402.48 C=CC(=O)Nc1cccc(-c2snc3cc(-c4ccc(N)c(OC)c4)cnc23)c1 Homo sapiens CHEMBL4736826 single protein format
CHEMBL4745028 OBDepict CH 3 O NH 2 N N S N H N H O IC50 = 13.0 nM 437.57 COc1cc(-c2cnc3c(N4CCC[C@H](CNC(=O)C5CC5)C4)snc3c2)ccc1N Homo sapiens CHEMBL4736826 single protein format
CHEMBL4800032 OBDepict CH 3 O NH 2 N N S N N H O IC50 = 14.0 nM 437.57 COc1cc(-c2cnc3c(N4CCCC(CNC(=O)C5CC5)C4)snc3c2)ccc1N Homo sapiens CHEMBL4736826 single protein format
CHEMBL4779229 OBDepict H 3 C O H 2 N N N S N H O IC50 = 17.0 nM 444.56 COc1cc(-c2cnc3c(-c4cccc(NC(=O)C5CCCC5)c4)snc3c2)ccc1N Homo sapiens CHEMBL4736826 single protein format
CHEMBL4646895 OBDepict H 3 C O O H 2 N N N S N H H 3 C O H CH 3 IC50 = 22.0 nM 398.49 COc1cc(-c2cnc3c(N4C[C@H](C)O[C@H](C)C4)snc3c2)ccc1C(N)=O Homo sapiens CHEMBL4610426 cell-based format
CHEMBL311959 OBDepict CH 3 O O N H 3 C N H O O H 3 C O H 3 C CH 3 IC50 = 23.0 nM 370.41 COc1cc2nccc(Nc3cc(OC)c(OC)c(OC)c3)c2cc1OC Homo sapiens CHEMBL4394509 cell-based format
CHEMBL4642467 OBDepict CH 3 O O CH 3 N N S N H H 3 C O H CH 3 IC50 = 24.0 nM 385.49 COc1ccc(-c2ccc3nsc(N4C[C@H](C)O[C@H](C)C4)c3n2)cc1OC Homo sapiens CHEMBL4610426 cell-based format
CHEMBL4440586 OBDepict N N N H O O CH 3 CH 3 HC IC50 = 31.0 nM 329.36 C#Cc1cccc(Nc2c(C#N)cnc3cc(OC)c(OC)cc23)c1 Homo sapiens CHEMBL4394509 cell-based format
CHEMBL4752286 OBDepict CH 3 O NH 2 N N S N N H O IC50 = 35.0 nM 473.6 COc1cc(-c2cnc3c(N4CCCC(CNC(=O)c5ccccc5)C4)snc3c2)ccc1N Homo sapiens CHEMBL4736826 single protein format
CHEMBL4784439 OBDepict H 3 C O H 2 N N N S N N H N O IC50 = 37.0 nM 466.61 COc1cc(-c2cnc3c(N4CCCC(CNC(=O)N5CCCC5)C4)snc3c2)ccc1N Homo sapiens CHEMBL4736826 single protein format
CHEMBL4755134 OBDepict H 3 C O H 2 N N N S N N H O IC50 = 39.0 nM 465.62 COc1cc(-c2cnc3c(N4CCCC(CNC(=O)C5CCCC5)C4)snc3c2)ccc1N Homo sapiens CHEMBL4736826 single protein format
CHEMBL4172550 OBDepict H 3 C O H 2 N N N S N H H 3 C O H CH 3 IC50 = 39.4 nM 370.48 COc1cc(-c2cnc3c(N4C[C@H](C)O[C@H](C)C4)snc3c2)ccc1N Homo sapiens CHEMBL4610426 cell-based format
CHEMBL4645917 OBDepict H 3 C O O HO N N S N H H 3 C O H CH 3 IC50 = 42.0 nM 399.47 COc1cc(-c2cnc3c(N4C[C@H](C)O[C@H](C)C4)snc3c2)ccc1C(=O)O Homo sapiens CHEMBL4610426 cell-based format
CHEMBL4443342 OBDepict H 3 C O O N H CH 3 O CH 3 N Br IC50 = 48.0 nM 389.25 COc1cc(Nc2ccnc3ccc(Br)cc23)cc(OC)c1OC Homo sapiens CHEMBL4394509 cell-based format
CHEMBL4535001 OBDepict OH O S N O O H 3 C CH 3 H 3 C N N H N N H 3 C H H 3 C Ki = 49.0 nM 419.51 Cc1[nH]nc(Nc2ncnc3cc(OCCO)c(S(=O)(=O)C(C)(C)C)cc23)c1C Homo sapiens CHEMBL4481506 assay format
CHEMBL3425867 OBDepict CH 3 O NH 2 N N S N O IC50 = 51.0 nM 342.42 COc1cc(-c2cnc3c(N4CCOCC4)snc3c2)ccc1N Homo sapiens CHEMBL4736826 single protein format
CHEMBL4790097 OBDepict CH 3 O NH 2 N N S N HN HN O IC50 = 62.0 nM 452.58 COc1cc(-c2cnc3c(N4CCCC(CNC(=O)NC5CC5)C4)snc3c2)ccc1N Homo sapiens CHEMBL4736826 single protein format
CHEMBL4760106 OBDepict CH 3 O NH 2 N N S N N H O CH 3 H 3 C IC50 = 69.0 nM 453.61 COc1cc(-c2cnc3c(N4CCCC(CNC(=O)CC(C)C)C4)snc3c2)ccc1N Homo sapiens CHEMBL4736826 single protein format
CHEMBL4642620 OBDepict H 3 C O O H 3 C O H 3 C N N S N H H 3 C O H CH 3 IC50 = 71.0 nM 415.52 COc1cc(-c2cnc3c(N4C[C@H](C)O[C@H](C)C4)snc3c2)cc(OC)c1OC Homo sapiens CHEMBL4610426 cell-based format
CHEMBL304929 OBDepict CH 3 O O CH 3 N N H N CH IC50 = 72.0 nM 305.34 C#Cc1cccc(Nc2ncnc3cc(OC)c(OC)cc23)c1 Homo sapiens CHEMBL4394509 cell-based format
CHEMBL4636314 OBDepict H 3 C O NH O N N S N H H 3 C O H CH 3 IC50 = 73.0 nM 488.61 COc1cc(-c2cnc3c(N4C[C@H](C)O[C@H](C)C4)snc3c2)ccc1C(=O)NCc1ccccc1 Homo sapiens CHEMBL4610426 cell-based format
CHEMBL4782363 OBDepict CH 3 N H O N S N N O H 2 N CH 3 IC50 = 74.0 nM 425.56 CCC(=O)NCC1CCCN(c2snc3cc(-c4ccc(N)c(OC)c4)cnc23)C1 Homo sapiens CHEMBL4736826 single protein format
CHEMBL4756485 OBDepict CH 2 N H O N S N N O H 2 N CH 3 IC50 = 78.0 nM 423.54 C=CC(=O)NCC1CCCN(c2snc3cc(-c4ccc(N)c(OC)c4)cnc23)C1 Homo sapiens CHEMBL4736826 single protein format
CHEMBL4753946 OBDepict CH 3 O NH 2 N N S N N H S O O IC50 = 78.0 nM 473.62 COc1cc(-c2cnc3c(N4CCCC(CNS(=O)(=O)C5CC5)C4)snc3c2)ccc1N Homo sapiens CHEMBL4736826 single protein format
CHEMBL4643096 OBDepict CH 3 O N O N N S N H CH 3 O H H 3 C IC50 = 83.0 nM 452.58 COc1cc(-c2cnc3c(N4C[C@H](C)O[C@H](C)C4)snc3c2)ccc1C(=O)N1CCCC1 Homo sapiens CHEMBL4610426 cell-based format
CHEMBL4799769 OBDepict CH 3 O NH 2 N N S N N H N O O IC50 = 85.0 nM 482.61 COc1cc(-c2cnc3c(N4CCCC(CNC(=O)N5CCOCC5)C4)snc3c2)ccc1N Homo sapiens CHEMBL4736826 single protein format
CHEMBL4641825 OBDepict CH 3 O N N S N H H 3 C O H CH 3 IC50 = 99.0 nM 355.46 COc1cccc(-c2ccc3nsc(N4C[C@H](C)O[C@H](C)C4)c3n2)c1 Homo sapiens CHEMBL4610426 cell-based format
CHEMBL4632903 OBDepict CH 3 O N O N N O S N H H 3 C O H CH 3 IC50 = 101.0 nM 468.58 COc1cc(-c2cnc3c(N4C[C@H](C)O[C@H](C)C4)snc3c2)ccc1C(=O)N1CCOCC1 Homo sapiens CHEMBL4610426 cell-based format
CHEMBL4639991 OBDepict F N N S N H H 3 C O H CH 3 IC50 = 110.0 nM 343.43 C[C@H]1CN(c2snc3ccc(-c4ccc(F)cc4)nc23)C[C@@H](C)O1 Homo sapiens CHEMBL4610426 cell-based format
CHEMBL4638602 OBDepict O N H O H 3 C N N S N H H 3 C O H CH 3 IC50 = 113.0 nM 398.49 COc1cc(-c2cnc3c(N4C[C@H](C)O[C@H](C)C4)snc3c2)ccc1NC=O Homo sapiens CHEMBL4610426 cell-based format
CHEMBL4632372 OBDepict CH 3 O N H O N N S N H CH 3 O H H 3 C IC50 = 118.0 nM 438.55 COc1cc(-c2cnc3c(N4C[C@H](C)O[C@H](C)C4)snc3c2)ccc1C(=O)NC1CC1 Homo sapiens CHEMBL4610426 cell-based format
CHEMBL4633404 OBDepict CH 3 O O CH 3 N N S N O IC50 = 124.0 nM 357.44 COc1ccc(-c2ccc3nsc(N4CCOCC4)c3n2)cc1OC Homo sapiens CHEMBL4610426 cell-based format
CHEMBL4642058 OBDepict CH 3 O O CH 3 N N S N O IC50 = 126.0 nM 357.44 COc1cc(OC)cc(-c2ccc3nsc(N4CCOCC4)c3n2)c1 Homo sapiens CHEMBL4610426 cell-based format
CHEMBL111038 OBDepict N N N H O O Br H 3 C CH 3 IC50 = 130.0 nM 384.23 COc1cc2ncc(C#N)c(Nc3cccc(Br)c3)c2cc1OC Homo sapiens CHEMBL4394509 cell-based format
CHEMBL4640730 OBDepict CH 3 O N H O CH 3 N N S N H CH 3 O H H 3 C IC50 = 132.0 nM 412.52 COc1cc(-c2cnc3c(N4C[C@H](C)O[C@H](C)C4)snc3c2)ccc1NC(C)=O Homo sapiens CHEMBL4610426 cell-based format
CHEMBL10 OBDepict F N N H N + S H 3 C _ O IC50 = 135.0 nM 377.44 C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1 Homo sapiens CHEMBL831128 single protein format
CHEMBL4635935 OBDepict CH 3 O N N S N O IC50 = 136.0 nM 327.41 COc1cccc(-c2ccc3nsc(N4CCOCC4)c3n2)c1 Homo sapiens CHEMBL4610426 cell-based format
CHEMBL3425876 OBDepict CH 3 O O CH 3 N N S N H CH 3 O H H 3 C IC50 = 136.0 nM 385.49 COc1ccc(-c2cnc3c(N4C[C@H](C)O[C@H](C)C4)snc3c2)cc1OC Homo sapiens CHEMBL4610426 cell-based format
CHEMBL535429 OBDepict H 3 C O O N H CH 3 O CH 3 N F F F IC50 = 170.0 nM 378.35 COc1cc(Nc2ccnc3ccc(C(F)(F)F)cc23)cc(OC)c1OC Homo sapiens CHEMBL4394509 cell-based format
CHEMBL4640641 OBDepict CH 3 O N H O N N S N H CH 3 O H H 3 C IC50 = 173.0 nM 438.55 COc1cc(-c2cnc3c(N4C[C@H](C)O[C@H](C)C4)snc3c2)ccc1NC(=O)C1CC1 Homo sapiens CHEMBL4610426 cell-based format
CHEMBL4777592 OBDepict H 3 C N H O N S N N O NH 2 H 3 C IC50 = 190.0 nM 439.59 CCC(=O)NCCC1CCCN(c2snc3cc(-c4ccc(N)c(OC)c4)cnc23)C1 Homo sapiens CHEMBL4736826 single protein format
CHEMBL4648802 OBDepict CH 3 N N S N H H 3 C O H CH 3 IC50 = 214.0 nM 339.46 Cc1ccc(-c2ccc3nsc(N4C[C@H](C)O[C@H](C)C4)c3n2)cc1 Homo sapiens CHEMBL4610426 cell-based format
CHEMBL3823499 OBDepict F N N H N H N S O O H 3 C CH 3 H 3 C Ki = 220.0 nM 398.46 CC(C)(C)S(=O)(=O)c1ccc2nccc(Nc3n[nH]c4ccc(F)cc34)c2c1 Homo sapiens CHEMBL4481506 assay format
CHEMBL29197 OBDepict CH 3 O O CH 3 N N H N Br IC50 = 260.0 nM 360.21 COc1cc2ncnc(Nc3cccc(Br)c3)c2cc1OC Homo sapiens CHEMBL4394509 cell-based format
CHEMBL4638387 OBDepict Cl N N S N H CH 3 O H H 3 C IC50 = 262.0 nM 359.88 C[C@H]1CN(c2snc3ccc(-c4cccc(Cl)c4)nc23)C[C@@H](C)O1 Homo sapiens CHEMBL4610426 cell-based format
CHEMBL309682 OBDepict CH 3 O O N H 3 C N N H O O H 3 C O H 3 C CH 3 IC50 = 350.0 nM 371.39 COc1cc2ncnc(Nc3cc(OC)c(OC)c(OC)c3)c2cc1OC Homo sapiens CHEMBL4394509 cell-based format
CHEMBL4747444 OBDepict CH 3 O NH 2 N N S N H N H O IC50 = 360.0 nM 437.57 COc1cc(-c2cnc3c(N4CCC[C@@H](CNC(=O)C5CC5)C4)snc3c2)ccc1N Homo sapiens CHEMBL4736826 single protein format
CHEMBL4470026 OBDepict CH 3 N S CH 3 NH O O N H N N H O Ki = 360.0 nM 427.53 CCN(C)S(=O)(=O)NCc1cccc(-c2ccc3c(NC(=O)C4CC4)n[nH]c3c2)c1 Homo sapiens CHEMBL4345185 assay format
CHEMBL4648554 OBDepict H CH 3 O N H H 3 C S N N IC50 = 364.0 nM 325.44 C[C@H]1CN(c2snc3ccc(-c4ccccc4)nc23)C[C@@H](C)O1 Homo sapiens CHEMBL4610426 cell-based format
CHEMBL4635431 OBDepict H 3 C O N H O N N S N H H 3 C O H CH 3 IC50 = 370.0 nM 474.59 COc1cc(-c2cnc3c(N4C[C@H](C)O[C@H](C)C4)snc3c2)ccc1NC(=O)c1ccccc1 Homo sapiens CHEMBL4610426 cell-based format
CHEMBL4781252 OBDepict CH 3 O N H N F F F IC50 = 380.0 nM 318.3 COc1cccc(Nc2ccnc3ccc(C(F)(F)F)cc23)c1 Homo sapiens CHEMBL4667719 single protein format
CHEMBL939 OBDepict CH 3 O O N N HN N Cl O F IC50 = 420.0 nM 446.91 COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1 Homo sapiens CHEMBL4394509 cell-based format
CHEMBL4637058 OBDepict CH 3 O O CH 3 O N CH 3 N S N H H 3 C O H CH 3 IC50 = 422.0 nM 415.52 COc1cc(-c2ccc3nsc(N4C[C@H](C)O[C@H](C)C4)c3n2)cc(OC)c1OC Homo sapiens CHEMBL4610426 cell-based format
CHEMBL4634338 OBDepict H 3 C O O N H H 3 C O H 3 C N N S N H H 3 C O H CH 3 IC50 = 458.0 nM 430.53 COc1cc(Nc2cnc3c(N4C[C@H](C)O[C@H](C)C4)snc3c2)cc(OC)c1OC Homo sapiens CHEMBL4610426 cell-based format
CHEMBL1092250 OBDepict CH 3 O O CH 3 N H N CH IC50 = 500.0 nM 304.35 C#Cc1cccc(Nc2ccnc3cc(OC)c(OC)cc23)c1 Homo sapiens CHEMBL4394509 cell-based format
CHEMBL4800155 OBDepict CH 2 N H O S N N O H 2 N CH 3 IC50 = 500.0 nM 402.48 C=CC(=O)Nc1ccc(-c2snc3cc(-c4ccc(N)c(OC)c4)cnc23)cc1 Homo sapiens CHEMBL4736826 single protein format
CHEMBL98248 OBDepict CH 3 O O CH 3 N H N Br IC50 = 510.0 nM 359.22 COc1cc2nccc(Nc3cccc(Br)c3)c2cc1OC Homo sapiens CHEMBL4394509 cell-based format
CHEMBL4447403 OBDepict O HN N N H N H S O O F F F Ki = 510.0 nM 466.49 O=C(Nc1n[nH]c2cc(-c3cccc(CNS(=O)(=O)CCC(F)(F)F)c3)ccc12)C1CC1 Homo sapiens CHEMBL4345185 assay format
CHEMBL4636735 OBDepict H 3 C O N N N S N H H 3 C O H CH 3 IC50 = 545.0 nM 356.45 COc1cc(-c2cnc3c(N4C[C@H](C)O[C@H](C)C4)snc3c2)ccn1 Homo sapiens CHEMBL4610426 cell-based format
CHEMBL4582326 OBDepict O HN N N H N H S O O F F F Ki = 580.0 nM 452.46 O=C(Nc1n[nH]c2cc(-c3cccc(CNS(=O)(=O)CC(F)(F)F)c3)ccc12)C1CC1 Homo sapiens CHEMBL4345185 assay format
CHEMBL4642436 OBDepict H H 3 C O N H CH 3 S N N IC50 = 661.0 nM 325.44 C[C@H]1CN(c2snc3cc(-c4ccccc4)cnc23)C[C@@H](C)O1 Homo sapiens CHEMBL4610426 cell-based format
CHEMBL4561238 OBDepict O HN N N H NH S N O O CH 3 F F F Ki = 780.0 nM 481.5 CN(CC(F)(F)F)S(=O)(=O)NCc1cccc(-c2ccc3c(NC(=O)C4CC4)n[nH]c3c2)c1 Homo sapiens CHEMBL4345185 assay format
CHEMBL4534959 OBDepict O N H N N H HN S O O Ki = 870.0 nM 410.5 O=C(Nc1n[nH]c2cc(-c3cccc(NS(=O)(=O)CC4CC4)c3)ccc12)C1CC1 Homo sapiens CHEMBL4345185 assay format
CHEMBL4798132 OBDepict CH 3 N H O N S N N O H 2 N CH 3 IC50 = 900.0 nM 411.53 CCC(=O)NC1CCCN(c2snc3cc(-c4ccc(N)c(OC)c4)cnc23)C1 Homo sapiens CHEMBL4736826 single protein format
CHEMBL553 OBDepict CH 3 O O O N N H N O CH 3 CH IC50 = 910.0 nM 393.44 C#Cc1cccc(Nc2ncnc3cc(OCCOC)c(OCCOC)cc23)c1 Homo sapiens CHEMBL4394509 cell-based format