HOME LIGAND hPROTEOME OTHERS DOCUMENT

P06239 | LCK_HUMAN | Tyrosine-protein kinase Lck (LCK)

3D structures mapped by conservation among orthologs

[ Domain: "Protein kinase" // Pkinase_Tyr ]

download pymol session

[ Domain: "SH2" // SH2 ]

download pymol session

[ Domain: "SH3" // SH3_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
CHEMBL215969 OBDepict CH 3 NH N N CH 3 N H O CH 3 F F F IC50 = 0.01 nM 450.46 CNc1ncc2cc(-c3cc(C(=O)Nc4cccc(C(F)(F)F)c4C)ccc3C)ccc2n1 Homo sapiens CHEMBL913225 single protein format
CHEMBL458333 OBDepict CH 3 O H 3 C CH 3 N N N N H N N H H 3 C H 3 C O N Ki = 0.04 nM 543.72 COC(C)(C)CCn1nc(Nc2c(C)cccc2C)c2cnc(Nc3ccc(OCCN4CCCC4)cc3)nc21 Homo sapiens CHEMBL1017274 single protein format
CHEMBL566813 OBDepict O N NH N H CH 3 N H CH 3 H N N N N IC50 = 0.06 nM 506.61 C[C@H](Nc1nccc(-n2cnc3ccccc32)n1)[C@@H]1CN(C(=O)Nc2cccc3ccccc23)CCN1C Homo sapiens CHEMBL1049046 single protein format
CHEMBL566284 OBDepict CH 3 N H N NH H 3 C H NH O N N N N N N H 2 N IC50 = 0.07 nM 599.7 C[C@H](Nc1nccc(-n2cnc3cc(-c4ccnc(N)n4)ccc32)n1)[C@@H]1CN(C(=O)Nc2cccc3ccccc23)CCN1C Homo sapiens CHEMBL1049046 single protein format
CHEMBL212181 OBDepict O N H CH 3 CH 3 F F F N N N H IC50 = 0.07 nM 476.5 Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2C)cc1-c1ccc2nc(NC3CC3)ncc2c1 Homo sapiens CHEMBL913225 single protein format
CHEMBL569496 OBDepict CH 3 N H N N H H 3 C H N H O N N N N IC50 = 0.07 nM 520.64 CCN1CCN(C(=O)Nc2cccc3ccccc23)C[C@H]1[C@H](C)Nc1nccc(-n2cnc3ccccc32)n1 Homo sapiens CHEMBL1049046 single protein format
CHEMBL572197 OBDepict CH 3 N H N N H H 3 C H NH O N N N N N IC50 = 0.12 nM 583.7 C[C@H](Nc1nccc(-n2cnc3cc(-c4ccncc4)ccc32)n1)[C@@H]1CN(C(=O)Nc2cccc3ccccc23)CCN1C Homo sapiens CHEMBL1049046 single protein format
CHEMBL386118 OBDepict OH HN N N H N CH 3 N S NH O CH 3 Cl IC50 = 0.2 nM 418.91 Cc1nc(NCCO)cc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)n1 Homo sapiens CHEMBL910552 single protein format
CHEMBL215943 OBDepict CH 3 NH O N N N H F F F N O IC50 = 0.2 nM 535.57 Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1-c1ccc2nc(NCCN3CCOCC3)ncc2c1 Homo sapiens CHEMBL913225 single protein format
CHEMBL385698 OBDepict HO NH N N H N S N H O H 3 C Cl IC50 < 0.2 nM 403.9 Cc1cccc(Cl)c1NC(=O)c1cnc(Nc2cccc(NCCO)n2)s1 Homo sapiens CHEMBL910552 single protein format
CHEMBL568762 OBDepict CH 3 CH 3 N H N N H CH 3 H HN O N N N N IC50 = 0.2 nM 548.7 CC(C)CN1CCN(C(=O)Nc2cccc3ccccc23)C[C@H]1[C@H](C)Nc1nccc(-n2cnc3ccccc32)n1 Homo sapiens CHEMBL1049046 single protein format
CHEMBL385937 OBDepict NH 2 N N CH 3 NH O F F F IC50 = 0.2 nM 422.41 Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1-c1ccc2nc(N)ncc2c1 Homo sapiens CHEMBL913225 single protein format
CHEMBL565263 OBDepict O N NH N H N H CH 3 H N N N N N IC50 = 0.2 nM 569.67 C[C@H](Nc1nccc(-n2cnc3ccccc32)n1)[C@@H]1CN(C(=O)Nc2cccc3ccccc23)CCN1c1ccncc1 Homo sapiens CHEMBL1049046 single protein format
CHEMBL569052 OBDepict H 3 C N N N H CH 3 N H O N N N N IC50 = 0.25 nM 506.61 CC(Nc1nccc(-n2cnc3ccccc32)n1)C1CN(C(=O)Nc2cccc3ccccc23)CCN1C Homo sapiens CHEMBL1049046 single protein format
CHEMBL1171837 OBDepict H 3 C N N F F F N H O CH 3 N N N IC50 = 0.28 nM 532.57 Cc1ccc(C(=O)Nc2ccc(CN3CCN(C)CC3)c(C(F)(F)F)c2)cc1C#Cc1cnc2cccnn12 Homo sapiens CHEMBL4721776 single protein format
CHEMBL405630 OBDepict O N H S N N H H 3 C H 3 C N N IC50 = 0.3 nM 325.4 Cc1cccc(C)c1NC(=O)c1cnc(Nc2cccnn2)s1 Homo sapiens CHEMBL910552 single protein format
CHEMBL607366 OBDepict NH 2 O N H N N O NH 2 O IC50 = 0.3 nM 455.52 NCCOc1ccc2c(c1)Nc1c(C(N)=O)c(-c3ccc(Oc4ccccc4)cc3)nn1CC2 Homo sapiens CHEMBL1049477 single protein format
CHEMBL212964 OBDepict CH 3 NH N N CH 3 N H O F F F IC50 = 0.3 nM 436.44 CNc1ncc2cc(-c3cc(C(=O)Nc4cccc(C(F)(F)F)c4)ccc3C)ccc2n1 Homo sapiens CHEMBL913225 single protein format
CHEMBL212128 OBDepict CH 3 N H N N CH 3 NH O F F F IC50 = 0.3 nM 436.44 CNc1ncc2cc(-c3cc(NC(=O)c4cccc(C(F)(F)F)c4)ccc3C)ccc2n1 Homo sapiens CHEMBL913225 single protein format
CHEMBL427233 OBDepict CH 3 NH N N CH 3 NH O IC50 = 0.3 nM 408.51 CNc1ncc2cc(-c3cc(C(=O)Nc4cccc5c4CCC5)ccc3C)ccc2n1 Homo sapiens CHEMBL913225 single protein format
CHEMBL212900 OBDepict NH 2 N N Cl N H O F F F IC50 = 0.4 nM 442.83 Nc1ncc2cc(-c3cc(C(=O)Nc4cccc(C(F)(F)F)c4)ccc3Cl)ccc2n1 Homo sapiens CHEMBL913225 single protein format
CHEMBL1421 OBDepict HO N N N N N H CH 3 N S N H O H 3 C Cl IC50 = 0.4 nM 488.02 Cc1nc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)cc(N2CCN(CCO)CC2)n1 Homo sapiens CHEMBL910552 single protein format
CHEMBL429582 OBDepict NH 2 N N CH 3 NH O F F F IC50 = 0.4 nM 422.41 Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1-c1ccc2nc(N)ncc2c1 Homo sapiens CHEMBL951931 single protein format
CHEMBL214530 OBDepict CH 3 NH O N N CH 3 N H F F F N O IC50 = 0.4 nM 563.62 Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2C)cc1-c1ccc2nc(NCCCN3CCOCC3)ncc2c1 Homo sapiens CHEMBL913225 single protein format
CHEMBL569272 OBDepict O N N H H N H CH 3 H N N N N IC50 = 0.4 nM 491.6 C[C@H](Nc1nccc(-n2cnc3ccccc32)n1)[C@H]1CCCN(C(=O)Nc2cccc3ccccc23)C1 Homo sapiens CHEMBL1049046 single protein format
CHEMBL591324 OBDepict NH 2 O N H N N O H 2 N O IC50 = 0.41 nM 455.52 NCCOc1ccc2c(c1)CCn1nc(-c3ccc(Oc4ccccc4)cc3)c(C(N)=O)c1N2 Homo sapiens CHEMBL1049477 single protein format
CHEMBL595398 OBDepict H 3 C N CH 3 O N H N N O H 2 N HO IC50 = 0.44 nM 407.47 CN(C)CCOc1ccc2c(c1)CCn1nc(-c3ccc(O)cc3)c(C(N)=O)c1N2 Homo sapiens CHEMBL1049477 single protein format
CHEMBL566507 OBDepict CH 3 O O N H N N H H 3 C H NH O N N N N IC50 = 0.45 nM 578.68 CCOC(=O)CN1CCN(C(=O)Nc2cccc3ccccc23)C[C@H]1[C@H](C)Nc1nccc(-n2cnc3ccccc32)n1 Homo sapiens CHEMBL1049046 single protein format
CHEMBL189649 OBDepict O N H S N NH H 3 C Cl N N N O IC50 = 0.5 nM 430.92 Cc1cccc(Cl)c1NC(=O)c1cnc(Nc2cc(N3CCOCC3)ncn2)s1 Homo sapiens CHEMBL910552 single protein format
CHEMBL424906 OBDepict O N H S N N H CH 3 Cl N N H N N IC50 < 0.5 nM 467.99 Cc1cccc(Cl)c1NC(=O)c1cnc(Nc2cccc(NCCCn3ccnc3)n2)s1 Homo sapiens CHEMBL910552 single protein format
CHEMBL186568 OBDepict CH 3 N N H N S N H O CH 3 Cl IC50 = 0.5 nM 358.85 Cc1ccnc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)c1 Homo sapiens CHEMBL910552 single protein format
CHEMBL273250 OBDepict O N H S N N H CH 3 Cl N N H N O IC50 = 0.5 nM 487.03 Cc1cccc(Cl)c1NC(=O)c1cnc(Nc2cccc(NCCCN3CCOCC3)n2)s1 Homo sapiens CHEMBL910552 single protein format
CHEMBL386661 OBDepict CH 3 NH N N CH 3 N H O O F F F N H 3 C IC50 = 0.5 nM 549.6 CNc1ncc2cc(-c3cc(C(=O)Nc4cc(C(F)(F)F)ccc4OC4CCN(C)CC4)ccc3C)ccc2n1 Homo sapiens CHEMBL913225 single protein format
CHEMBL212953 OBDepict CH 3 N CH 3 HN O HN O F F F H 3 C N N N H H 3 C IC50 = 0.5 nM 564.61 CCN(CC)CC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(C)c(-c2ccc3nc(NC)ncc3c2)c1 Homo sapiens CHEMBL913225 single protein format
CHEMBL312933 OBDepict OH N H N N H S N NH O CH 3 Cl IC50 = 0.5 nM 453.96 Cc1cccc(Cl)c1NC(=O)c1ccc2nc(Nc3cccc(NCCO)n3)sc2c1 Homo sapiens CHEMBL841198 single protein format
CHEMBL215019 OBDepict CH 3 HN N N H 3 C N H O Cl F F F IC50 = 0.5 nM 470.88 CNc1ncc2cc(-c3cc(C(=O)Nc4ccc(Cl)c(C(F)(F)F)c4)ccc3C)ccc2n1 Homo sapiens CHEMBL913225 single protein format
CHEMBL215745 OBDepict CH 3 HN N N H 3 C F N H O F F F IC50 = 0.5 nM 454.43 CNc1ncc2cc(-c3cc(C(=O)Nc4cccc(C(F)(F)F)c4)c(F)cc3C)ccc2n1 Homo sapiens CHEMBL913225 single protein format
CHEMBL408070 OBDepict CH 3 N N N H N N HN O CH 3 NH O F F F IC50 = 0.5 nM 589.62 Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1C(=O)Nc1cnc(Nc2ccc(N3CCN(C)CC3)cc2)nc1 Homo sapiens CHEMBL951931 single protein format
CHEMBL592260 OBDepict H 3 C N CH 3 O N H N N O NH 2 O IC50 = 0.51 nM 497.6 CN(C)CCCOc1ccc2c(c1)Nc1c(C(N)=O)c(-c3ccc(Oc4ccccc4)cc3)nn1CC2 Homo sapiens CHEMBL1049477 single protein format
CHEMBL432189 OBDepict CH 3 N N N H N H S N O N H O CH 3 Cl Ki = 0.54 nM 509.04 Cc1cc(Nc2nc3ccc(C(=O)Nc4c(C)cccc4Cl)cc3s2)nc(NCC2CCCO2)n1 Homo sapiens CHEMBL841380 single protein format
CHEMBL592262 OBDepict H 3 C N N O N H N N O H 2 N O IC50 = 0.55 nM 538.65 CN1CCN(CCOc2ccc3c(c2)Nc2c(C(N)=O)c(-c4ccc(Oc5ccccc5)cc4)nn2CC3)CC1 Homo sapiens CHEMBL1049477 single protein format
CHEMBL596079 OBDepict NH 2 O N H N N O O N O IC50 = 0.56 nM 525.61 NC(=O)c1c(-c2ccc(Oc3ccccc3)cc2)nn2c1Nc1ccc(OCCN3CCOCC3)cc1CC2 Homo sapiens CHEMBL1049477 single protein format
CHEMBL215813 OBDepict NH 2 N N CH 3 NH O CH 3 F F F IC50 = 0.6 nM 436.44 Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2C)cc1-c1ccc2nc(N)ncc2c1 Homo sapiens CHEMBL913225 single protein format
CHEMBL272888 OBDepict CH 3 N N N H N N HN O CH 3 N H O F F F IC50 = 0.6 nM 589.62 Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1C(=O)Nc1cnc(Nc2ccc(N3CCN(C)CC3)cc2)nc1 Homo sapiens CHEMBL951931 single protein format
CHEMBL215691 OBDepict H 3 C N N H N N H 3 C HN O H 3 C F F F IC50 = 0.6 nM 533.6 Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2C)cc1-c1ccc2nc(NC3CCN(C)CC3)ncc2c1 Homo sapiens CHEMBL913225 single protein format
CHEMBL365505 OBDepict CH 3 N N H N S N H O CH 3 Cl IC50 = 0.6 nM 358.85 Cc1cccc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)n1 Homo sapiens CHEMBL910552 single protein format
CHEMBL214617 OBDepict CH 3 N N HN NH N S N N H O O CH 3 Cl IC50 = 0.7 nM 502.04 Cc1nc(NCCCN2CCOCC2)cc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)n1 Homo sapiens CHEMBL910552 single protein format
CHEMBL216240 OBDepict OH N N N H N CH 3 N S N H O H 3 C Cl IC50 = 0.7 nM 473.0 Cc1nc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)cc(N2CCC(CO)CC2)n1 Homo sapiens CHEMBL910552 single protein format
CHEMBL281957 OBDepict CH 3 N CH 3 N CH 3 HO N N H 3 C N H Cl Cl IC50 = 0.7 nM 484.43 CCN(CC)C/C=C/c1nc(O)c2c(ccc3nc(Nc4c(Cl)cccc4Cl)n(C)c32)c1C Homo sapiens CHEMBL841204 single protein format
CHEMBL591325 OBDepict H 3 C N CH 3 O N H N N O H 2 N O IC50 = 0.72 nM 483.57 CN(C)CCOc1ccc2c(c1)CCn1nc(-c3ccc(Oc4ccccc4)cc3)c(C(N)=O)c1N2 Homo sapiens CHEMBL1049477 single protein format
CHEMBL601096 OBDepict OH O N H N N O NH 2 O IC50 = 0.75 nM 456.5 NC(=O)c1c(-c2ccc(Oc3ccccc3)cc2)nn2c1Nc1ccc(OCCO)cc1CC2 Homo sapiens CHEMBL1049477 single protein format
CHEMBL3980550 OBDepict CH 3 N H 3 C N H O N N N N H 2 N O IC50 = 0.76 nM 511.63 CN(C)C/C=C/C(=O)NC1CCC(n2nc(-c3ccc(Oc4ccccc4)cc3)c3c(N)ncnc32)CC1 Homo sapiens CHEMBL3888242 single protein format
CHEMBL3893004 OBDepict CH 3 N CH 3 HN O H H N N N N H 2 N O IC50 = 0.76 nM 511.63 CN(C)C/C=C/C(=O)N[C@H]1CC[C@H](n2nc(-c3ccc(Oc4ccccc4)cc3)c3c(N)ncnc32)CC1 Homo sapiens CHEMBL3887536 single protein format
CHEMBL591793 OBDepict NH 2 O N N H N O O N O IC50 = 0.77 nM 525.61 NC(=O)c1c(-c2ccc(Oc3ccccc3)cc2)nn2c1Nc1cc(OCCN3CCOCC3)ccc1CC2 Homo sapiens CHEMBL1049477 single protein format
CHEMBL595624 OBDepict H 3 C N CH 3 O N H N N O H 2 N N H IC50 = 0.8 nM 482.59 CN(C)CCOc1ccc2c(c1)CCn1nc(-c3ccc(Nc4ccccc4)cc3)c(C(N)=O)c1N2 Homo sapiens CHEMBL1049477 single protein format
CHEMBL3912266 OBDepict CH 2 HN O H H N N N N H 2 N O IC50 = 0.88 nM 454.53 C=CC(=O)N[C@H]1CC[C@H](n2nc(-c3ccc(Oc4ccccc4)cc3)c3c(N)ncnc32)CC1 Homo sapiens CHEMBL3887536 single protein format
CHEMBL312933 OBDepict OH N H N N H S N NH O CH 3 Cl Ki = 0.9 nM 453.96 Cc1cccc(Cl)c1NC(=O)c1ccc2nc(Nc3cccc(NCCO)n3)sc2c1 Homo sapiens CHEMBL841380 single protein format
CHEMBL213428 OBDepict NH 2 N N CH 3 F NH O F F F IC50 = 0.9 nM 440.4 Cc1cc(F)c(C(=O)Nc2cccc(C(F)(F)F)c2)cc1-c1ccc2nc(N)ncc2c1 Homo sapiens CHEMBL913225 single protein format
CHEMBL582959 OBDepict H 3 C N CH 3 O N H N N O H 2 N N H NH O Cl Cl IC50 = 0.94 nM 594.5 CN(C)CCOc1ccc2c(c1)CCn1nc(-c3ccc(NC(=O)Nc4c(Cl)cccc4Cl)cc3)c(C(N)=O)c1N2 Homo sapiens CHEMBL1049477 single protein format
CHEMBL263769 OBDepict CH 3 N N N H N N N O O O F CH 3 H 3 C CH 3 H 3 C IC50 = 1.0 nM 584.7 Cc1cccc(C)c1OC(=O)N(c1ccnc(Nc2ccc(N3CCN(C)CC3)cc2)n1)c1ccc(F)cc1OC(C)C Homo sapiens CHEMBL870977 single protein format
CHEMBL442485 OBDepict CH 3 O N O O O N H 3 C N N H CH 3 H 3 C N N CH 3 IC50 = 1.0 nM 568.68 COc1ccc(OC)c(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Nc3ccc(N4CCN(C)CC4)cc3)n2)c1 Homo sapiens CHEMBL870977 single protein format
CHEMBL566373 OBDepict CH 3 N O N N N N N N H CH 3 H IC50 = 1.0 nM 427.51 CCN1CCN(c2ccc3c(c2)ncn3-c2ccnc(N[C@@H](C)c3ccccc3)n2)C1=O Homo sapiens CHEMBL1049046 single protein format
CHEMBL211845 OBDepict CH 3 O N O H 3 C O O N N N H H 3 C CH 3 F N N CH 3 IC50 = 1.0 nM 586.67 COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Nc3ccc(N4CCN(C)CC4)c(F)c3)n2)c(OC)c1 Homo sapiens CHEMBL870977 single protein format
CHEMBL212721 OBDepict CH 3 O N O H 3 C O O N N N H H 3 C CH 3 O N CH 3 CH 3 IC50 = 1.0 nM 557.65 COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Nc3ccc(OCCN(C)C)cc3)n2)c(OC)c1 Homo sapiens CHEMBL870977 single protein format
CHEMBL211460 OBDepict CH 3 O N O O N N N H CH 3 H 3 C N N CH 3 IC50 = 1.0 nM 538.65 COc1ccccc1N(C(=O)Oc1c(C)cccc1C)c1ccnc(Nc2ccc(N3CCN(C)CC3)cc2)n1 Homo sapiens CHEMBL870977 single protein format
CHEMBL214775 OBDepict CH 3 O N O CH 3 O O N N HN CH 3 H 3 C O N CH 3 H 3 C IC50 = 1.0 nM 571.68 COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Nc3ccc(OCCCN(C)C)cc3)n2)c(OC)c1 Homo sapiens CHEMBL870977 single protein format
CHEMBL379733 OBDepict CH 3 O N O H 3 C O O N N N H H 3 C CH 3 O N IC50 = 1.0 nM 597.72 COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Nc3ccc(OCCN4CCCCC4)cc3)n2)c(OC)c1 Homo sapiens CHEMBL870977 single protein format
CHEMBL591326 OBDepict CH 3 N CH 3 O N H N N O H 2 N O IC50 = 1.0 nM 497.6 CN(C)CCCOc1ccc2c(c1)CCn1nc(-c3ccc(Oc4ccccc4)cc3)c(C(N)=O)c1N2 Homo sapiens CHEMBL1049477 single protein format
CHEMBL215730 OBDepict CH 3 O N N H N N N CH 3 N O O O CH 3 O CH 3 H 3 C H 3 C IC50 = 1.0 nM 598.7 COc1ccc(N(C(=O)Oc2c(C)cccc2C)c2ccnc(Nc3ccc(N4CCN(C)CC4)c(OC)c3)n2)c(OC)c1 Homo sapiens CHEMBL870977 single protein format
CHEMBL1762530 OBDepict HO N CH 3 CH 3 N N N H N N O O IC50 < 1.0 nM 490.61 Cc1ccc(CO)cc1N(C)c1ccnc(Nc2cc(N3CCOCC3)cc(N3CCOCC3)c2)n1 Homo sapiens CHEMBL1763677 single protein format
CHEMBL567029 OBDepict O N NH N CH 3 CH 3 N H CH 3 H N N N N IC50 = 1.0 nM 520.64 C[C@H](Nc1nccc(-n2cnc3ccccc32)n1)[C@]1(C)CN(C(=O)Nc2cccc3ccccc23)CCN1C Homo sapiens CHEMBL1049046 single protein format
CHEMBL1650533 OBDepict CH 3 N H 3 C H 3 C HO N S NH N N N CH 3 N N H ClH IC50 < 1.0 nM 463.01 CCN(Cc1cc(Nc2nc(C)cn3c(-c4cn[nH]c4)cnc23)sn1)C(C)(C)CO.Cl Homo sapiens CHEMBL1656201 single protein format
CHEMBL601719 OBDepict NH 2 N O CH 3 H N N Cl Cl F HN IC50 < 1.0 nM 450.35 C[C@@H](Oc1cc(-c2cnn(C3CCNCC3)c2)cnc1N)c1c(Cl)ccc(F)c1Cl Homo sapiens CHEMBL1825469 single protein format
CHEMBL215863 OBDepict CH 3 N H O N N CH 3 N H F F F IC50 = 1.0 nM 512.54 Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2C)cc1-c1ccc2nc(Nc3ccccc3)ncc2c1 Homo sapiens CHEMBL913225 single protein format
CHEMBL270057 OBDepict CH 3 O O CH 3 O N O N N H O CH 3 IC50 = 1.0 nM 471.51 COc1cc2nccc(Oc3ccc4c(c3)OCCN4C(=O)Nc3cccc(C)c3)c2cc1OC Homo sapiens CHEMBL950179 single protein format
CHEMBL108907 OBDepict H 3 C N N N N N N H CH 3 Cl IC50 = 1.0 nM 406.92 Cc1cccc(Cl)c1Nc1nc2ccc(N3CCN(C)CC3)cc2n2cncc12 Homo sapiens CHEMBL706269 single protein format
CHEMBL4228240 OBDepict OH N H 3 C N S NH N N N CH 3 N N H IC50 < 1.0 nM 398.5 CCN(CCO)Cc1cc(Nc2nc(C)cn3c(-c4cn[nH]c4)cnc23)sn1 Homo sapiens CHEMBL4222449 single protein format
CHEMBL315643 OBDepict O HN S H 3 C Cl N N H N N O IC50 = 1.0 nM 494.02 Cc1cccc(Cl)c1NC(=O)c1ccc2nc(Nc3cc(CN4CCOCC4)ccn3)sc2c1 Homo sapiens CHEMBL841198 single protein format
CHEMBL270692 OBDepict CH 3 O O O CH 3 H 3 C N H N N N N N H N H 3 C CH 3 IC50 = 1.0 nM 497.56 COc1cc(Nc2ncnc(-n3c(Nc4c(C)cccc4C)nc4ccccc43)n2)cc(OC)c1OC Homo sapiens CHEMBL934187 single protein format
CHEMBL1232515 OBDepict CH 3 N H 3 C H 3 C HO N S NH N N N CH 3 N N H IC50 <= 1.0 nM 426.55 CCN(Cc1cc(Nc2nc(C)cn3c(-c4cn[nH]c4)cnc23)sn1)C(C)(C)CO Homo sapiens CHEMBL1272506 single protein format
CHEMBL86939 OBDepict H 3 C N H N N N N H S N HN O CH 3 Cl IC50 = 1.0 nM 522.08 CNN1CCN(Cc2ccnc(Nc3nc4ccc(C(=O)Nc5c(C)cccc5Cl)cc4s3)c2)CC1 Homo sapiens CHEMBL841198 single protein format
CHEMBL432189 OBDepict CH 3 N N N H N H S N O N H O CH 3 Cl IC50 = 1.0 nM 509.04 Cc1cc(Nc2nc3ccc(C(=O)Nc4c(C)cccc4Cl)cc3s2)nc(NCC2CCCO2)n1 Homo sapiens CHEMBL841198 single protein format
CHEMBL427226 OBDepict CH 3 NH N N CH 3 N H O O N H 3 C IC50 = 1.0 nM 481.6 CNc1ncc2cc(-c3cc(C(=O)Nc4ccc(OC5CCN(C)CC5)cc4)ccc3C)ccc2n1 Homo sapiens CHEMBL913225 single protein 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 CHEMBL3887536 single protein format
CHEMBL364623 OBDepict CH 3 N N H N H 3 C N S N H O H 3 C Cl IC50 = 1.0 nM 373.87 Cc1cc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)nc(C)n1 Homo sapiens CHEMBL910552 single protein format
CHEMBL595401 OBDepict H 3 C N CH 3 O N H N N O H 2 N N H Cl Cl IC50 = 1.0 nM 565.51 CN(C)CCOc1ccc2c(c1)CCn1nc(-c3ccc(NCc4c(Cl)cccc4Cl)cc3)c(C(N)=O)c1N2 Homo sapiens CHEMBL1049477 single protein format
CHEMBL375840 OBDepict O HN H 3 C F F F N N N H IC50 < 1.0 nM 420.39 Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1C#Cc1cnc2[nH]cnc2c1 Homo sapiens CHEMBL910168 single protein format
CHEMBL605724 OBDepict OH O O N H N N O NH 2 O IC50 = 1.0 nM 470.49 NC(=O)c1c(-c2ccc(Oc3ccccc3)cc2)nn2c1Nc1cc(OCC(=O)O)ccc1CC2 Homo sapiens CHEMBL1049477 single protein format
CHEMBL218632 OBDepict CH 3 HN N N N O CH 3 HN O F F F IC50 < 1.0 nM 479.46 CNc1nccc(-c2cccnc2Oc2cc(C(=O)Nc3cccc(C(F)(F)F)c3)ccc2C)n1 Homo sapiens CHEMBL910168 single protein format
CHEMBL567885 OBDepict CH 3 N H N N N N H O N N IC50 = 1.0 nM 491.6 CC(Nc1nccc(-n2cnc3ccccc32)n1)C1CCCN(C(=O)Nc2cccc3ccccc23)C1 Homo sapiens CHEMBL1049046 single protein format
CHEMBL220874 OBDepict H 2 N N H 3 C HN O F F F IC50 = 1.0 nM 395.38 Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1C#Cc1ccc(N)nc1 Homo sapiens CHEMBL910168 single protein format
CHEMBL427998 OBDepict H 2 N N N H 3 C HN O F F F IC50 = 1.0 nM 396.37 Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1C#Cc1cnc(N)nc1 Homo sapiens CHEMBL910168 single protein format
CHEMBL219584 OBDepict CH 3 HN O N F F F IC50 = 1.0 nM 430.43 Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1C#Cc1cnc2ccccc2c1 Homo sapiens CHEMBL910168 single protein format
CHEMBL603859 OBDepict CH 3 N N O N H N N O H 2 N O IC50 = 1.1 nM 538.65 CN1CCN(CCOc2ccc3c(c2)CCn2nc(-c4ccc(Oc5ccccc5)cc4)c(C(N)=O)c2N3)CC1 Homo sapiens CHEMBL1049477 single protein format
CHEMBL386745 OBDepict O N H S N N H H 3 C H 3 C N IC50 = 1.2 nM 324.41 Cc1cccc(C)c1NC(=O)c1cnc(Nc2ccccn2)s1 Homo sapiens CHEMBL910552 single protein format
CHEMBL603737 OBDepict NH 2 O O N H N N O H 2 N O IC50 = 1.2 nM 469.5 NC(=O)COc1ccc2c(c1)CCn1nc(-c3ccc(Oc4ccccc4)cc3)c(C(N)=O)c1N2 Homo sapiens CHEMBL1049477 single protein format
CHEMBL189776 OBDepict O N H S N N H H 3 C Cl N IC50 = 1.2 nM 344.83 Cc1cccc(Cl)c1NC(=O)c1cnc(Nc2ccccn2)s1 Homo sapiens CHEMBL910552 single protein format
CHEMBL591322 OBDepict CH 3 N H 3 C O N H N N O H 2 N O IC50 = 1.2 nM 483.57 CN(C)CCOc1ccc2c(c1)Nc1c(C(N)=O)c(-c3ccc(Oc4ccccc4)cc3)nn1CC2 Homo sapiens CHEMBL1049477 single protein format
CHEMBL566515 OBDepict H 3 C O N N N H 3 C N OH H 3 C O N O H IC50 = 1.3 nM 417.43 COc1ccccc1-n1c(-c2cc(O)ccc2C)cn2c3c(=O)[nH]c(=O)n(C)c3nc12 Homo sapiens CHEMBL2344635 single protein format
CHEMBL217039 OBDepict CH 3 N N N H N N S O N H O CH 3 Cl IC50 = 1.3 nM 444.95 Cc1nc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)cc(N2CCOCC2)n1 Homo sapiens CHEMBL910552 single protein format