HOME LIGAND hPROTEOME OTHERS DOCUMENT

Q05397 | FAK1_HUMAN | Focal adhesion kinase 1 (PTK2)

3D structures mapped by conservation among orthologs

[ Domain: "Acyl-CoA binding protein-like" // FERM_M ]

download pymol session

[ Domain: "PH domain-like" // FERM_C_FAK1 ]

download pymol session

[ Domain: "Ubiquitin-like" // KOG4257 ]

download pymol session

[ Domain: "FAT domain of focal adhesion kinase" // Focal_AT ]

download pymol session

[ Domain: "Periplasmic binding protein-like II" // SBP_bac_1_N_1 ]

download pymol session

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

download pymol session



[ 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
CHEMBL4752642 OBDepict H 2 C N H O N H O HN O N H N N N H Cl N H O H 3 C Ki = 0.23 nM 575.03 C=CC(=O)NCCNc1c(NCc2ccc(Nc3ncc(Cl)c(Nc4ccccc4C(=O)NC)n3)cc2)c(=O)c1=O Homo sapiens CHEMBL4704548 cell-based format
CHEMBL3692193 OBDepict CH 3 N HN N N F F F O NH 2 IC50 = 0.3 nM 469.51 CN1CCc2cc(Nc3ncc(C(F)(F)F)c(CCc4ccccc4CC(N)=O)n3)ccc2C1 Homo sapiens CHEMBL3705701 cell-based format
CHEMBL3692188 OBDepict NH 2 O N N N H F F F N O CH 3 IC50 = 0.39 nM 525.58 CC(=O)N1CCC(c2ccc(Nc3ncc(C(F)(F)F)c(CCc4ccccc4CC(N)=O)n3)cc2)CC1 Homo sapiens CHEMBL3705701 cell-based format
CHEMBL487229 OBDepict O N H HN N N N H F F F N S H 3 C O O H 3 C IC50 = 0.5 nM 506.51 CN(c1ccccc1CNc1nc(Nc2ccc3c(c2)CNC3=O)ncc1C(F)(F)F)S(C)(=O)=O Homo sapiens CHEMBL962347 single protein format
CHEMBL3892377 OBDepict CH 2 N S O O CH 3 N N H N N N H F F F Br IC50 = 0.51 nM 557.4 C=CCN(c1ncccc1CNc1nc(Nc2cccc(Br)c2)ncc1C(F)(F)F)S(C)(=O)=O Homo sapiens CHEMBL3873677 cell-based format
CHEMBL3639910 OBDepict NH 2 O N N N H F F F N N O CH 3 IC50 = 0.6 nM 526.56 CC(=O)N1CCN(c2ccc(Nc3ncc(C(F)(F)F)c(CCc4ccccc4CC(N)=O)n3)cc2)CC1 Homo sapiens CHEMBL3705701 cell-based format
CHEMBL4862042 OBDepict CH 3 HN O HN N N N H F F F N N S H 3 C O O H 3 C IC50 = 0.6 nM 509.51 CNC(=O)c1ccc(Nc2ncc(C(F)(F)F)c(NCc3cccnc3N(C)S(C)(=O)=O)n2)cc1 Homo sapiens CHEMBL4814464 single protein format
CHEMBL4752642 OBDepict H 2 C N H O N H O HN O N H N N N H Cl N H O H 3 C IC50 = 0.6 nM 575.03 C=CC(=O)NCCNc1c(NCc2ccc(Nc3ncc(Cl)c(Nc4ccccc4C(=O)NC)n3)cc2)c(=O)c1=O Homo sapiens CHEMBL4704547 cell-based format
CHEMBL3137331 OBDepict CH 3 HN O HN N N N H F F F N N N S H 3 C O O H 3 C IC50 = 0.6 nM 510.5 CNC(=O)c1ccc(Nc2ncc(C(F)(F)F)c(NCc3nccnc3N(C)S(C)(=O)=O)n2)cc1 Homo sapiens CHEMBL4353544 single protein format
CHEMBL3692189 OBDepict NH 2 O N N N H F F F N O CH 3 IC50 = 0.77 nM 525.58 CC(=O)C1CCN(c2ccc(Nc3ncc(C(F)(F)F)c(CCc4ccccc4CC(N)=O)n3)cc2)CC1 Homo sapiens CHEMBL3705701 cell-based format
CHEMBL3692185 OBDepict NH 2 N N H N N F F F O NH 2 IC50 = 0.81 nM 498.55 NC(=O)Cc1ccccc1CCc1nc(Nc2ccc(N3CCC(N)CC3)cc2)ncc1C(F)(F)F Homo sapiens CHEMBL3705701 cell-based format
CHEMBL488247 OBDepict CH 3 N S O O H 3 C N H N N NH F F F S O O CH 3 IC50 = 0.94 nM 529.57 CN(c1ccccc1CNc1nc(Nc2ccc(S(C)(=O)=O)cc2)ncc1C(F)(F)F)S(C)(=O)=O Homo sapiens CHEMBL962347 single protein format
CHEMBL3657345 OBDepict CH 3 O NH O N N H O H O O H H HO F F F O N H 3 C H 3 C IC50 = 1.0 nM 588.54 COc1cc(O[C@@H]2CO[C@@H]3[C@H](O)CO[C@H]23)ccc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3C)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657352 OBDepict H 3 C O N H N N N N O H 3 C N O IC50 = 1.0 nM 470.53 COc1cc(N2CCN(C)CC2)ccc1Nc1ncc(C#N)c(Oc2cccc3c2C(=O)CC3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657354 OBDepict CH 3 O NH N H O Cl N N O N N H 3 C O IC50 = 1.0 nM 547.02 COc1cc(C(=O)NC2CCN(C)CC2)c(Cl)cc1Nc1ncc(C#N)c(Oc2cccc3c2C(=O)CC3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657368 OBDepict OH OH H HN O F O CH 3 N H N N O F F F O N H 3 C IC50 = 1.0 nM 565.48 COc1cc(C(=O)NC[C@H](O)CO)c(F)cc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657365 OBDepict CH 3 O N H HN O F N N O N CH 3 CH 3 F F F O N H 3 C IC50 = 1.0 nM 562.52 COc1cc(C(=O)NCCN(C)C)c(F)cc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657344 OBDepict CH 3 O NH N H O N N O N F F F H 3 C O N CH 3 CH 3 IC50 = 1.0 nM 584.6 COc1cc(C(=O)NC2CCN(C)CC2)ccc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3C)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657371 OBDepict CH 3 O NH Cl N H O N N H O H F Cl N H 3 C O N CH 3 IC50 = 1.0 nM 589.46 COc1cc(C(=O)N[C@H]2CCN(C)C[C@H]2F)c(Cl)cc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657376 OBDepict CH 3 O HN N H O CH 3 N N O N CH 3 F F F O N H 3 C IC50 = 1.0 nM 584.6 COc1cc(C(=O)NC2CCCN(C)C2)c(C)cc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657357 OBDepict H 3 C O N O O N N HN F F F O CH 3 N H O H N CH 3 IC50 = 1.0 nM 586.57 COc1cc(C(=O)N[C@@H]2CCCN(C)C2)ccc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(OC)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657341 OBDepict H 3 C O N H N N N N O H 3 C F F F O N CH 3 IC50 = 1.0 nM 528.54 COc1cc(N2CCN(C)CC2)ccc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657332 OBDepict CH 3 O HN N H O Cl N N O Cl N CH 3 O N H 3 C IC50 = 1.0 nM 571.47 COc1cc(C(=O)NC2CCN(C)CC2)c(Cl)cc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657333 OBDepict H 3 C O N H N N N CH 3 H 3 C O F F F O N CH 3 IC50 = 1.0 nM 487.48 COc1cc(CN(C)C)ccc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657331 OBDepict CH 3 O N H N N N N O CH 3 Cl O N H 3 C H 3 C IC50 = 1.0 nM 509.01 COc1cc(N2CCN(C)CC2)ccc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)N(C)C3C)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657323 OBDepict CH 3 O N O O N Cl N NH O F CH 3 N H O N H 3 C IC50 = 1.0 nM 571.01 COc1cc(C(=O)NC2CCN(C)CC2)c(F)cc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)N(OC)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657320 OBDepict CH 3 O NH N H O N N O Cl N H 3 C O N CH 3 IC50 = 1.0 nM 537.02 COc1cc(C(=O)NC2CCN(C)CC2)ccc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657312 OBDepict CH 3 O NH N H O N N H O H F N F F F H 3 C O N CH 3 IC50 = 1.0 nM 588.56 COc1cc(C(=O)N[C@H]2CCN(C)C[C@H]2F)ccc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657311 OBDepict CH 3 O HN N H O F N N O N F F F CH 3 O N H 3 C IC50 = 1.0 nM 588.56 COc1cc(C(=O)NC2CCN(C)CC2)c(F)cc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657306 OBDepict CH 3 O NH N H O N N H O H F N F F F H 3 C O N CH 3 IC50 = 1.0 nM 588.56 COc1cc(C(=O)N[C@@H]2CCN(C)C[C@@H]2F)ccc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657281 OBDepict CH 3 O HN N H O N N O N F F F CH 3 O N H 3 C IC50 = 1.0 nM 570.57 COc1cc(C(=O)NC2CCN(C)CC2)ccc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3972653 OBDepict OH N N H O N H CH 3 N N N H Cl N H O CH 3 IC50 = 1.0 nM 580.13 CNC(=O)c1ccccc1Nc1nc(Nc2ccc3c(c2OC)CCC[C@@H](N2CCN(CCO)CC2)C3)ncc1Cl Homo sapiens CHEMBL3858244 assay format
CHEMBL452341 OBDepict CH 3 N S O O CH 3 N H N N N H F F F NH S O O IC50 = 1.0 nM 542.57 CN(c1ccccc1CNc1nc(Nc2ccc3c(c2)CS(=O)(=O)N3)ncc1C(F)(F)F)S(C)(=O)=O Homo sapiens CHEMBL962347 single protein format
CHEMBL3657334 OBDepict CH 3 O N H N N N O F F F O N CH 3 IC50 = 1.0 nM 513.52 COc1cc(CN2CCCC2)ccc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657377 OBDepict CH 3 O NH H 3 C N H O N N H O N H 3 C F F F O N CH 3 IC50 = 1.0 nM 584.6 COc1cc(C(=O)N[C@@H]2CCCN(C)C2)c(C)cc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657381 OBDepict CH 3 HN O CH 3 O CH 3 N H N N O F F F O N H 3 C IC50 = 1.0 nM 501.47 CNC(=O)c1cc(OC)c(Nc2ncc(C(F)(F)F)c(Oc3cccc4c3C(=O)N(C)C4)n2)cc1C Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657382 OBDepict CH 3 O HN N H O CH 3 N N O N F F F CH 3 O N H 3 C IC50 = 1.0 nM 584.6 COc1cc(C(=O)NC2CCN(C)CC2)c(C)cc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3661455 OBDepict CH 3 O N H N N N O H 3 C CH 3 F F F O N H 3 C IC50 = 1.0 nM 511.5 COc1cc(C#CCN(C)C)ccc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3661445 OBDepict H 3 C O N H N N N N O F F F N O CH 3 CH 3 O N CH 3 IC50 = 1.0 nM 599.61 COc1cc(N2CCN(CC(=O)N(C)C)CC2)ccc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3661444 OBDepict H 3 C O N H N N N N O CH 3 H 3 C F F F O N CH 3 IC50 = 1.0 nM 556.59 COc1cc(N2CCN(C(C)C)CC2)ccc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3661443 OBDepict OH OH H O N H CH 3 N N O F F F O N H 3 C IC50 = 1.0 nM 504.47 COc1cc(C[C@H](O)CO)ccc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3661442 OBDepict OH OH H O N H CH 3 N N O F F F O N H 3 C IC50 = 1.0 nM 504.47 COc1cc(C[C@@H](O)CO)ccc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3661439 OBDepict CH 3 O HN O O N H CH 3 N N O F F F O N H 3 C IC50 = 1.0 nM 531.49 COCCNC(=O)c1ccc(Nc2ncc(C(F)(F)F)c(Oc3cccc4c3C(=O)N(C)C4)n2)c(OC)c1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3661437 OBDepict H 3 C N N H O CH 3 NH N N O F F F O N CH 3 IC50 = 1.0 nM 554.57 Cc1cc(C(=O)NC2CCN(C)CC2)ccc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3661436 OBDepict CH 3 N N H O CH 3 HN N N O F F F O N H 3 C IC50 = 1.0 nM 554.57 Cc1cc(C(=O)NC2CCCN(C)C2)ccc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3661430 OBDepict CH 3 O N N H O H 3 C HN N N O F F F O N H 3 C IC50 = 1.0 nM 598.63 COCCN1CCC(NC(=O)c2ccc(Nc3ncc(C(F)(F)F)c(Oc4cccc5c4C(=O)N(C)C5)n3)c(C)c2)CC1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3661428 OBDepict HO N N H O CH 3 NH N N O F F F O N CH 3 IC50 = 1.0 nM 584.6 Cc1cc(C(=O)NC2CCN(CCO)CC2)ccc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3661425 OBDepict CH 3 O NH O O N H H 3 C N N O F F F O N CH 3 IC50 = 1.0 nM 503.44 CONC(=O)c1ccc(Nc2ncc(C(F)(F)F)c(Oc3cccc4c3C(=O)N(C)C4)n2)c(OC)c1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657379 OBDepict CH 3 O N H HN O CH 3 N N O N CH 3 CH 3 F F F O N H 3 C IC50 = 1.0 nM 558.56 COc1cc(C(=O)NCCN(C)C)c(C)cc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657412 OBDepict CH 3 O NH H 3 C N H O N N H O H F Cl N H 3 C O N CH 3 CH 3 CH 3 IC50 = 1.0 nM 597.09 COc1cc(C(=O)N[C@H]2CCN(C)C[C@H]2F)c(C)cc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)N(C)C3(C)C)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657408 OBDepict CH 3 O HN CH 3 N H O N N H O H O Cl N CH 3 CH 3 O N H 3 C IC50 = 1.0 nM 581.07 COc1cc(C(=O)N[C@@H]2CCN(C)C[C@@H]2OC)c(C)cc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657407 OBDepict CH 3 O HN F N H O N N H O H O Cl N CH 3 CH 3 O N H 3 C IC50 = 1.0 nM 585.04 COc1cc(C(=O)N[C@@H]2CCN(C)C[C@@H]2OC)c(F)cc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657405 OBDepict CH 3 O NH F N H O N N H O H F Cl N H 3 C O N CH 3 H CH 3 IC50 = 1.0 nM 587.03 COc1cc(C(=O)N[C@H]2CCN(C)C[C@H]2F)c(F)cc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)N(C)[C@H]3C)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657402 OBDepict CH 3 O NH F N H O N N H O H O Cl N H 3 C H 3 C O N CH 3 H CH 3 IC50 = 1.0 nM 599.06 COc1cc(C(=O)N[C@@H]2CCN(C)C[C@@H]2OC)c(F)cc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)N(C)[C@@H]3C)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657401 OBDepict CH 3 O NH F N H O N N H O H F Cl N H 3 C O N CH 3 H CH 3 IC50 = 1.0 nM 587.03 COc1cc(C(=O)N[C@H]2CCN(C)C[C@H]2F)c(F)cc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)N(C)[C@@H]3C)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657400 OBDepict CH 3 O NH F N H O N N H O H O Cl N H 3 C H 3 C O N CH 3 H CH 3 IC50 = 1.0 nM 599.06 COc1cc(C(=O)N[C@@H]2CCN(C)C[C@@H]2OC)c(F)cc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)N(C)[C@H]3C)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657396 OBDepict CH 3 O N O O N Cl N NH O F CH 3 N H O H H F N H 3 C IC50 = 1.0 nM 589.0 COc1cc(C(=O)N[C@H]2CCN(C)C[C@H]2F)c(F)cc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)N(OC)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657388 OBDepict CH 3 O NH N H O F N N O Cl N H 3 C O N CH 3 H CH 3 IC50 = 1.0 nM 569.04 COc1cc(C(=O)NC2CCN(C)CC2)c(F)cc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)N(C)[C@@H]3C)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657387 OBDepict CH 3 O NH N H O F N N O Cl N H 3 C O N CH 3 H CH 3 IC50 = 1.0 nM 569.04 COc1cc(C(=O)NC2CCN(C)CC2)c(F)cc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)N(C)[C@H]3C)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657386 OBDepict CH 3 O NH N H O Cl N N O Cl N H 3 C O N CH 3 H CH 3 IC50 = 1.0 nM 585.49 COc1cc(C(=O)NC2CCN(C)CC2)c(Cl)cc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)N(C)[C@@H]3C)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657385 OBDepict CH 3 O NH N H O Cl N N O Cl N H 3 C O N CH 3 H CH 3 IC50 = 1.0 nM 585.49 COc1cc(C(=O)NC2CCN(C)CC2)c(Cl)cc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)N(C)[C@H]3C)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657409 OBDepict CH 3 O NH H 3 C N H O N N H O H F Cl N H 3 C O N CH 3 IC50 = 1.0 nM 569.04 COc1cc(C(=O)N[C@H]2CCN(C)C[C@H]2F)c(C)cc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657383 OBDepict CH 3 O HN N H O CH 3 N N O Cl N CH 3 O N H 3 C IC50 = 1.0 nM 551.05 COc1cc(C(=O)NC2CCN(C)CC2)c(C)cc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657378 OBDepict CH 3 O NH H 3 C N H O N N H O N H 3 C F F F O N CH 3 IC50 = 1.0 nM 584.6 COc1cc(C(=O)N[C@H]2CCCN(C)C2)c(C)cc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3949755 OBDepict F F F N N H N HN N N S O O CH 3 IC50 = 1.26 nM 478.5 CS(=O)(=O)N1CCCc2cccc(c2)Nc2ncc(C(F)(F)F)c(n2)NCc2cccnc21 Homo sapiens CHEMBL3873677 cell-based format
CHEMBL3040440 OBDepict CH 3 HN O NH N N H F F F O CH 3 N O IC50 = 1.5 nM 501.51 CNC(=O)c1ccccc1Nc1cc(Nc2ccc(N3CCOCC3)cc2OC)ncc1C(F)(F)F Homo sapiens CHEMBL4679492 cell-based format
CHEMBL3692172 OBDepict NH 2 O N N N H F F F N H IC50 = 1.5 nM 483.54 NC(=O)Cc1ccccc1CCc1nc(Nc2ccc(C3CCCNC3)cc2)ncc1C(F)(F)F Homo sapiens CHEMBL3705701 cell-based format
CHEMBL1084546 OBDepict O N H HN N N N H F F F N N S H 3 C O O H 3 C IC50 = 1.5 nM 507.5 CN(c1ncccc1CNc1nc(Nc2ccc3c(c2)CC(=O)N3)ncc1C(F)(F)F)S(C)(=O)=O Homo sapiens CHEMBL1117899 single protein format
CHEMBL472212 OBDepict O N H HN N N N H F F F N S H 3 C O O H 3 C IC50 = 1.5 nM 506.51 CN(c1ccccc1CNc1nc(Nc2ccc3c(c2)CC(=O)N3)ncc1C(F)(F)F)S(C)(=O)=O Homo sapiens CHEMBL962347 single protein format
CHEMBL2430358 OBDepict CH 3 HN O NH N N H F F F O CH 3 N O ClH IC50 = 1.5 nM 537.97 CNC(=O)c1ccccc1Nc1cc(Nc2ccc(N3CCOCC3)cc2OC)ncc1C(F)(F)F.Cl Homo sapiens CHEMBL2432164 cell-based format
CHEMBL4874046 OBDepict CH 3 N H O N H N N N H F F F O CH 3 IC50 = 1.87 nM 417.39 CNC(=O)c1ccc(Nc2ncc(C(F)(F)F)c(Nc3ccccc3OC)n2)cc1 Homo sapiens CHEMBL4824298 single protein format
CHEMBL3692171 OBDepict CH 3 N N N H N N F F F O H 2 N IC50 = 1.9 nM 498.55 CN1CCN(c2ccc(Nc3ncc(C(F)(F)F)c(CCc4ccccc4CC(N)=O)n3)cc2)CC1 Homo sapiens CHEMBL3705701 cell-based format
CHEMBL513744 OBDepict O NH N H N N N H F F F N S CH 3 O O CH 3 IC50 = 1.9 nM 506.51 CN(c1cccc(CNc2nc(Nc3ccc4c(c3)CC(=O)N4)ncc2C(F)(F)F)c1)S(C)(=O)=O Homo sapiens CHEMBL962347 single protein format
CHEMBL3689069 OBDepict H 3 C O N H N N N HN F F F O NH 2 IC50 = 1.9 nM 514.55 COc1cc(N2CCNCC2)ccc1Nc1ncc(C(F)(F)F)c(CCc2ccccc2CC(N)=O)n1 Homo sapiens CHEMBL3705933 cell-based format
CHEMBL3657318 OBDepict CH 3 O NH N H O N N O N F F F H 3 C O N CH 3 IC50 = 2.0 nM 584.6 COc1cc(C(=O)NC2CCN(C)CC2)ccc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)CC3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657366 OBDepict CH 3 O NH N H O F N N H O F F F H HO O N CH 3 IC50 = 2.0 nM 589.55 COc1cc(C(=O)N[C@H]2CC[C@H](O)CC2)c(F)cc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3661447 OBDepict CH 3 O N H N N N N O F F F O O N CH 3 IC50 = 2.0 nM 570.57 COc1cc(N2CCN(C3COC3)CC2)ccc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657369 OBDepict CH 3 O NH N H O F N N O Cl N H 3 C O IC50 = 2.0 nM 540.0 COc1cc(C(=O)NC2CCN(C)CC2)c(F)cc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)CC3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657374 OBDepict H 3 C O N H N N N N O F F F O N H 3 C IC50 = 2.0 nM 568.6 COc1cc(N2CCN(CC3CC3)CC2)ccc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3661427 OBDepict CH 3 O HN O CH 3 N H N N O F F F O N H 3 C IC50 = 2.0 nM 515.49 COCCNC(=O)c1ccc(Nc2ncc(C(F)(F)F)c(Oc3cccc4c3C(=O)N(C)C4)n2)c(C)c1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657282 OBDepict H 3 C O N O O N N HN F F F O CH 3 N H O N CH 3 IC50 = 2.0 nM 586.57 COc1cc(C(=O)NC2CCN(C)CC2)ccc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(OC)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657303 OBDepict CH 3 N N H O O HN CH 3 N N O F F F O N H 3 C IC50 = 2.0 nM 584.6 CCN1CCC(NC(=O)c2ccc(Nc3ncc(C(F)(F)F)c(Oc4cccc5c4C(=O)N(C)C5)n3)c(OC)c2)CC1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3951811 OBDepict OH N N H O N H CH 3 N N N H Cl N H O CH 3 IC50 = 2.0 nM 580.13 CNC(=O)c1ccccc1Nc1nc(Nc2ccc3c(c2OC)CCC[C@H](N2CCN(CCO)CC2)C3)ncc1Cl Homo sapiens CHEMBL3858244 assay format
CHEMBL3657319 OBDepict CH 3 O NH N H O N N O Br N H 3 C O IC50 = 2.0 nM 566.46 COc1cc(C(=O)NC2CCN(C)CC2)ccc1Nc1ncc(Br)c(Oc2cccc3c2C(=O)CC3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657391 OBDepict H 3 C O N H N H O CH 3 N N O Cl O N H 3 C IC50 = 2.0 nM 507.98 COc1cc(C(=O)NCC2CC2)c(C)cc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657406 OBDepict CH 3 O NH F N H O N N H O H F Cl N H 3 C O N CH 3 IC50 = 2.0 nM 573.0 COc1cc(C(=O)N[C@@H]2CCN(C)C[C@@H]2F)c(F)cc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657348 OBDepict CH 3 O HN N H O F N N O Cl N CH 3 O N H 3 C IC50 = 2.0 nM 555.01 COc1cc(C(=O)NC2CCN(C)CC2)c(F)cc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657342 OBDepict CH 3 N N H F HN N N O F F F O N H 3 C IC50 = 2.0 nM 530.53 CN1CCC(Nc2ccc(Nc3ncc(C(F)(F)F)c(Oc4cccc5c4C(=O)N(C)C5)n3)cc2F)CC1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657353 OBDepict CH 3 O NH N H O F N N O N N H 3 C O IC50 = 2.0 nM 530.56 COc1cc(C(=O)NC2CCN(C)CC2)c(F)cc1Nc1ncc(C#N)c(Oc2cccc3c2C(=O)CC3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657325 OBDepict H 3 C O N H N N N N O H 3 C Cl O IC50 = 2.0 nM 479.97 COc1cc(N2CCN(C)CC2)ccc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)CC3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3661431 OBDepict H 3 C NH O CH 3 N H N N O F F F O N CH 3 IC50 = 2.0 nM 471.44 CNC(=O)c1ccc(Nc2ncc(C(F)(F)F)c(Oc3cccc4c3C(=O)N(C)C4)n2)c(C)c1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3661432 OBDepict CH 3 HN O O N H CH 3 N N O F F F O N H 3 C IC50 = 2.0 nM 487.44 CNC(=O)c1ccc(Nc2ncc(C(F)(F)F)c(Oc3cccc4c3C(=O)N(C)C4)n2)c(OC)c1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657265 OBDepict CH 3 O HN N H O N N O N F F F CH 3 O IC50 = 2.0 nM 555.56 COc1cc(C(=O)NC2CCN(C)CC2)ccc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)CC3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657283 OBDepict CH 3 O HN N H O N N O N F F F CH 3 O H 3 C IC50 = 2.0 nM 569.58 COc1cc(C(=O)NC2CCN(C)CC2)ccc1Nc1ncc(C(F)(F)F)c(Oc2ccc(C)c3c2C(=O)CC3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3657249 OBDepict CH 3 O HN N H O N N H O H F N F F F CH 3 O IC50 = 2.0 nM 573.55 COc1cc(C(=O)N[C@H]2CCN(C)C[C@H]2F)ccc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)CC3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3692181 OBDepict CH 3 N N H N N F F F O H 2 N IC50 = 2.0 nM 497.57 CN1CCC(c2ccc(Nc3ncc(C(F)(F)F)c(CCc4ccccc4CC(N)=O)n3)cc2)CC1 Homo sapiens CHEMBL3705701 cell-based format
CHEMBL3661441 OBDepict CH 3 O N H N N N H 3 C CH 3 O Cl O N H 3 C IC50 = 2.0 nM 453.93 COc1cc(CN(C)C)ccc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)N(C)C3)n1 Homo sapiens CHEMBL3705417 single protein format
CHEMBL3689074 OBDepict H 3 C O N H N N N H 3 C F F F O NH 2 IC50 = 2.1 nM 513.56 COc1cc(C2CCN(C)CC2)ccc1Nc1ncc(C(F)(F)F)c(CCc2cccc(C(N)=O)c2)n1 Homo sapiens CHEMBL3705933 cell-based format
CHEMBL3692169 OBDepict NH 2 O N N N H F F F N NH IC50 = 2.1 nM 484.53 NC(=O)Cc1ccccc1CCc1nc(Nc2ccc(N3CCNCC3)cc2)ncc1C(F)(F)F Homo sapiens CHEMBL3705701 cell-based format
CHEMBL3689079 OBDepict CH 3 N O N H F F F N N F F F O H 2 N IC50 = 2.2 nM 581.56 CN1CCC(c2ccc(Nc3ncc(C(F)(F)F)c(CCc4ccccc4CC(N)=O)n3)c(OC(F)(F)F)c2)CC1 Homo sapiens CHEMBL3705933 cell-based format