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P00519 | ABL1_HUMAN | Tyrosine-protein kinase ABL1 (ABL1)

3D structures mapped by conservation among orthologs

[ Domain: "SH2" // SH2 ]

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[ Domain: "SH3" // SH3_1 ]

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[ Domain: "F-actin binding domain of Abl" // F_actin_bind ]

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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
CHEMBL4867931 OBDepict H 3 C O N H S N O O H 2 N O HN IC50 = -53700.0 nM 464.55 COc1cc(NS(=O)(=O)C2CC2)ccc1-c1cnc(N)c(-c2ccc3c(c2)CCNC3=O)c1 Homo sapiens CHEMBL4804335 cell-based format
CHEMBL4855730 OBDepict F NH S N O O H 2 N O HN IC50 = -3000.0 nM 452.51 Nc1ncc(-c2ccc(NS(=O)(=O)C3CC3)cc2F)cc1-c1ccc2c(c1)CCNC2=O Homo sapiens CHEMBL4804335 cell-based format
CHEMBL4868141 OBDepict H 2 N N O O HN NH S O O IC50 = -2800.0 nM 532.67 Nc1ncc(-c2ccc(NS(=O)(=O)C3CC3)cc2OC2CCCCC2)cc1-c1ccc2c(c1)CCNC2=O Homo sapiens CHEMBL4804335 cell-based format
CHEMBL2347725 OBDepict CH 3 O S N N H NH O N N H 3 C IC50 = 0.015 nM 425.56 COc1ccccc1-c1ccc2nc(NC(=O)NCCN3CCN(C)CC3)sc2c1 Homo sapiens CHEMBL2353816 assay format
CHEMBL3689722 OBDepict O N H H H F N N H 3 C F Ki = 0.0186 nM 339.35 Cc1c(F)cncc1-c1ccc2cc(NC(=O)[C@@H]3C[C@@H]3F)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685056 OBDepict OH H 3 C N N H O Ki = 0.02 nM 318.38 Cc1ccc(O)cc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685101 OBDepict F N H O N N CH 3 Ki = 0.02 nM 321.36 Cc1ccncc1-c1ccc2cc(NC(=O)C3CC3F)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689554 OBDepict OH N F H 3 C N N H O Ki = 0.02 nM 351.38 Cc1c(-c2ccc3cc(NC(=O)C4CC4)ncc3c2)cnc(CO)c1F Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685180 OBDepict OH N H 3 C N N H O Ki = 0.02 nM 333.39 Cc1cc(CO)ncc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL1221411 OBDepict NH 2 HN O N H N N N H 3 C O Cl Cl Ki = 0.02 nM 469.33 Cn1c(=O)c(-c2c(Cl)cccc2Cl)cc2cnc(Nc3cccc(NC(=O)CN)c3)nc21 Homo sapiens CHEMBL1227835 single protein format
CHEMBL3689631 OBDepict O N H H F N N CH 3 OH H F F F Ki = 0.02 nM 419.38 Cc1cc([C@H](O)C(F)(F)F)ncc1-c1ccc2cc(NC(=O)C3C[C@@H]3F)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL577269 OBDepict NH 2 N H N N N CH 3 O Cl Cl Ki = 0.02 nM 412.28 Cn1c(=O)c(-c2c(Cl)cccc2Cl)cc2cnc(Nc3cccc(N)c3)nc21 Homo sapiens CHEMBL1227835 single protein format
CHEMBL3689678 OBDepict O N H H H F N N H 3 C N N H Ki = 0.02 nM 361.38 Cc1ccc2[nH]ncc2c1-c1cc2cnc(NC(=O)[C@@H]3C[C@@H]3F)cc2cn1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3639840 OBDepict O N H N N CH 3 F Ki = 0.02 nM 321.36 Cc1c(F)cncc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL2347722 OBDepict CH 3 O S N N H HN O N O IC50 = 0.021 nM 412.52 COc1ccccc1-c1ccc2nc(NC(=O)NCCN3CCOCC3)sc2c1 Homo sapiens CHEMBL2353816 assay format
CHEMBL3689597 OBDepict O N H N N CH 3 OH H F F F Ki = 0.03 nM 401.39 Cc1cc([C@@H](O)C(F)(F)F)ncc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685089 OBDepict O N H N CH 3 OH Ki = 0.03 nM 318.38 Cc1c(O)cccc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685095 OBDepict O N H N CH 3 HO F Ki = 0.03 nM 336.37 Cc1cc(F)c(O)cc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685096 OBDepict HO CH 3 N N H O Ki = 0.03 nM 332.4 Cc1ccc(CO)cc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689574 OBDepict O N H N CH 3 N N H Ki = 0.03 nM 342.4 Cc1ccc2[nH]ncc2c1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689596 OBDepict O N H N N CH 3 OH H F F F Ki = 0.03 nM 401.39 Cc1cc([C@H](O)C(F)(F)F)ncc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685020 OBDepict O N H N N CH 3 Ki = 0.03 nM 303.37 Cc1ccncc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685134 OBDepict O N H N N N H Ki = 0.04 nM 328.38 O=C(Nc1cc2ccc(-c3cccc4[nH]ncc34)cc2cn1)C1CC1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685023 OBDepict OH Cl N N H O Ki = 0.04 nM 338.79 O=C(Nc1cc2ccc(-c3cc(O)ccc3Cl)cc2cn1)C1CC1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689575 OBDepict O N H N CH 3 N N N H Ki = 0.04 nM 343.39 Cc1ncc2[nH]ncc2c1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685179 OBDepict O N H N N CH 3 OH Ki = 0.04 nM 319.36 Cc1c(O)cncc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689567 OBDepict O N H N N CH 3 HO CH 3 H Ki = 0.05 nM 347.42 Cc1cc([C@@H](C)O)ncc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689568 OBDepict O N H N N CH 3 HO CH 3 H Ki = 0.05 nM 347.42 Cc1cc([C@H](C)O)ncc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689578 OBDepict O N H H H F N N H 3 C Ki = 0.05 nM 321.36 Cc1ccncc1-c1ccc2cc(NC(=O)[C@@H]3C[C@@H]3F)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689577 OBDepict O N H H H F N N H 3 C Ki = 0.06 nM 321.36 Cc1ccncc1-c1ccc2cc(NC(=O)[C@H]3C[C@H]3F)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685068 OBDepict N F N N H O Ki = 0.06 nM 331.35 N#Cc1cc(F)ccc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL250213 OBDepict OH Cl H 3 C N N N N H N Ki = 0.062 nM 474.01 Cc1cc(-c2cc(O)ccc2Cl)cc2nnc(Nc3ccc(CCCN4CCCC4)cc3)nc12 Homo sapiens CHEMBL923928 single protein format
CHEMBL2347711 OBDepict H 3 C N H N H O S N O H 3 C IC50 = 0.064 nM 341.44 CCNC(=O)Nc1nc2ccc(-c3ccccc3OCC)cc2s1 Homo sapiens CHEMBL2353816 assay format
CHEMBL2347723 OBDepict OH N H N H O N S O H 3 C IC50 = 0.064 nM 343.41 COc1ccccc1-c1ccc2nc(NC(=O)NCCO)sc2c1 Homo sapiens CHEMBL2353816 assay format
CHEMBL3685147 OBDepict O N H N N Cl Ki = 0.07 nM 323.78 O=C(Nc1cc2ccc(-c3cnccc3Cl)cc2cn1)C1CC1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685181 OBDepict OH N CH 3 N N H O Ki = 0.07 nM 333.39 Cc1ccnc(CO)c1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689608 OBDepict O N H H F N N CH 3 Ki = 0.07 nM 321.36 Cc1ccncc1-c1ccc2cc(NC(=O)C3C[C@H]3F)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685055 OBDepict N F F N N H O Ki = 0.07 nM 349.34 N#Cc1cc(F)c(F)cc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689609 OBDepict O N H H F N N CH 3 Ki = 0.07 nM 321.36 Cc1ccncc1-c1ccc2cc(NC(=O)C3C[C@@H]3F)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689696 OBDepict O N H N CH 3 F Ki = 0.0709 nM 320.37 Cc1cccc(F)c1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689719 OBDepict O N H N N N N H Ki = 0.0723 nM 329.36 O=C(Nc1cc2ccc(-c3cccc4[nH]nnc34)cc2cn1)C1CC1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689649 OBDepict F H 3 C N CH 3 N N H O Ki = 0.08 nM 335.38 Cc1ccc(F)cc1-c1cc2cnc(NC(=O)C3CC3)cc2c(C)n1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689723 OBDepict O N H N + N _ O CH 3 Ki = 0.0896 nM 319.36 Cc1ccc[n+]([O-])c1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689548 OBDepict O N H N CH 3 N H N O Ki = 0.09 nM 414.51 Cc1ccc(NC(=O)N2CCCC2)cc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685178 OBDepict O N H N N CH 3 NH 2 Ki = 0.09 nM 318.38 Cc1c(N)cncc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685097 OBDepict O N H N HO F Ki = 0.09 nM 322.34 O=C(Nc1cc2ccc(-c3ccc(F)c(O)c3)cc2cn1)C1CC1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685177 OBDepict CH 3 N CH 3 N H O CH 3 N N H O Ki = 0.1 nM 478.6 Cc1ccc(NC(=O)c2ccc(CN(C)C)cc2)cc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689670 OBDepict HO CH 3 N N N H O Ki = 0.1 nM 333.39 Cc1ccc(CO)cc1-c1cc2cnc(NC(=O)C3CC3)cc2cn1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685172 OBDepict OH N N N H O Ki = 0.1 nM 319.36 O=C(Nc1cc2ccc(-c3cccnc3CO)cc2cn1)C1CC1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689636 OBDepict O N H N CH 3 N Cl Ki = 0.1 nM 337.81 Cc1nc(-c2ccccc2Cl)cc2cnc(NC(=O)C3CC3)cc12 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685155 OBDepict OH N N H N N CH 3 Ki = 0.1 nM 342.4 Cc1ccncc1-c1ccc2cc(Nc3cc(CO)ccn3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685146 OBDepict O N H N N CH 3 Cl Ki = 0.1 nM 337.81 Cc1cc(Cl)ncc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689646 OBDepict F CH 3 N N N H O Ki = 0.1 nM 321.36 Cc1ccc(F)cc1-c1cc2cnc(NC(=O)C3CC3)cc2cn1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689633 OBDepict CH 3 NH NH O N N CH 3 Ki = 0.1 nM 292.34 CNC(=O)Nc1cc2ccc(-c3cnccc3C)cc2cn1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689632 OBDepict O N H H F N N CH 3 OH H F F F Ki = 0.1 nM 419.38 Cc1cc([C@@H](O)C(F)(F)F)ncc1-c1ccc2cc(NC(=O)C3C[C@@H]3F)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685102 OBDepict O N H N N N H 3 C H Ki = 0.1 nM 292.34 Cc1c[nH]nc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685009 OBDepict F N H O N CH 3 F Ki = 0.1 nM 338.36 Cc1ccc(F)cc1-c1ccc2cc(NC(=O)C3CC3F)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689607 OBDepict O N H F F N N H 3 C Ki = 0.1 nM 339.35 Cc1ccncc1-c1ccc2cc(NC(=O)C3CC3(F)F)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689606 OBDepict OH N H 3 C N N H O Ki = 0.1 nM 319.36 Cc1ncc(O)cc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685072 OBDepict CH 3 NH NH O N CH 3 F Ki = 0.1 nM 309.34 CNC(=O)Nc1cc2ccc(-c3cc(F)ccc3C)cc2cn1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685035 OBDepict O N H N N CH 3 Ki = 0.1 nM 303.37 Cc1cccnc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685048 OBDepict O N H H F N CH 3 F Ki = 0.1 nM 338.36 Cc1ccc(F)cc1-c1ccc2cc(NC(=O)C3C[C@@H]3F)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685049 OBDepict O N H H F N CH 3 F Ki = 0.1 nM 338.36 Cc1ccc(F)cc1-c1ccc2cc(NC(=O)C3C[C@H]3F)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689666 OBDepict F CH 3 N N N N N H H 3 C O Ki = 0.1 nM 401.45 Cc1ccc(F)cc1-c1cc2cnc(NC(=O)C3CC3)cc2c(-c2cnn(C)c2)n1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689544 OBDepict O N H N N CH 3 HO H 3 C CH 3 Ki = 0.1 nM 361.45 Cc1cc(C(C)(C)O)ncc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689667 OBDepict F CH 3 N N N N N H H O Ki = 0.1 nM 387.42 Cc1ccc(F)cc1-c1cc2cnc(NC(=O)C3CC3)cc2c(-c2cn[nH]c2)n1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3929380 OBDepict N N N N N H O H HO H OH O Cl F F IC50 < 0.1 nM 501.88 N#Cc1cncc(-c2cc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cnc2N2C[C@H](O)[C@@H](O)C2)c1 Homo sapiens CHEMBL3888132 single protein format
CHEMBL3909373 OBDepict N N H N N N H O H OH H HO O F F F IC50 < 0.1 nM 473.41 N#Cc1ccc(-c2cc(C(=O)Nc3ccc(OC(F)(F)F)cc3)cnc2N2C[C@H](O)[C@@H](O)C2)[nH]1 Homo sapiens CHEMBL3888453 single protein format
CHEMBL4474070 OBDepict NH 2 O O N N N CH 3 N HN N S N H O H 3 C Cl Ki = 0.103 nM 575.14 Cc1nc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)cc(N2CCN(CCOCCOCCN)CC2)n1 Homo sapiens CHEMBL4312055 single protein format
CHEMBL2347710 OBDepict H 3 C N H N H O N S O CH 3 IC50 = 0.11 nM 327.41 CCNC(=O)Nc1nc2ccc(-c3ccccc3OC)cc2s1 Homo sapiens CHEMBL2353816 assay format
CHEMBL2347719 OBDepict H 3 C N H N H O N S O CH 3 H 2 N IC50 = 0.11 nM 342.42 CCNC(=O)Nc1nc2ccc(-c3ccc(N)cc3OC)cc2s1 Homo sapiens CHEMBL2353816 assay format
CHEMBL3689700 OBDepict F H 3 C N N H O Ki = 0.116 nM 320.37 Cc1ccc(F)cc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL2347729 OBDepict CH 3 O S N N H NH O N N H IC50 = 0.12 nM 425.56 CCOc1ccccc1-c1ccc2nc(NC(=O)NCCN3CCNCC3)sc2c1 Homo sapiens CHEMBL2353816 assay format
CHEMBL2347728 OBDepict OH N H N H O N S O H 3 C IC50 = 0.13 nM 371.46 CCOc1ccccc1-c1ccc2nc(NC(=O)NCCCO)sc2c1 Homo sapiens CHEMBL2353816 assay format
CHEMBL3689720 OBDepict F N H N N N H O Ki = 0.158 nM 346.37 O=C(Nc1cc2ccc(-c3cc(F)cc4[nH]ncc34)cc2cn1)C1CC1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689697 OBDepict O N H N CH 3 Cl Ki = 0.158 nM 336.82 Cc1cccc(Cl)c1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL2347724 OBDepict HO N H N H O N S O CH 3 IC50 = 0.16 nM 357.44 COc1ccccc1-c1ccc2nc(NC(=O)NCCCO)sc2c1 Homo sapiens CHEMBL2353816 assay format
CHEMBL3689695 OBDepict O N H N F Cl F Ki = 0.164 nM 358.78 O=C(Nc1cc2ccc(-c3c(F)ccc(F)c3Cl)cc2cn1)C1CC1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689743 OBDepict _ O + N H 3 C N N H O Ki = 0.167 nM 319.36 Cc1cc[n+]([O-])cc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689718 OBDepict O N H H H F N N N CH 3 F Ki = 0.168 nM 340.33 Cc1c(F)cncc1-c1cc2cnc(NC(=O)[C@@H]3C[C@@H]3F)cc2cn1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL2316583 OBDepict CH 3 N N F F F N H O N N N H IC50 = 0.17 nM 518.54 CN1CCN(Cc2ccc(NC(=O)c3cccc(C#Cc4cnc5[nH]ncc5c4)c3)cc2C(F)(F)F)CC1 Homo sapiens CHEMBL2320765 cell-based format
CHEMBL3689706 OBDepict N N N H O Ki = 0.173 nM 313.36 N#Cc1ccccc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689699 OBDepict O N H N F F Ki = 0.175 nM 324.33 O=C(Nc1cc2ccc(-c3c(F)cccc3F)cc2cn1)C1CC1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL2347727 OBDepict HO N H N H O N S O CH 3 IC50 = 0.18 nM 357.44 CCOc1ccccc1-c1ccc2nc(NC(=O)NCCO)sc2c1 Homo sapiens CHEMBL2353816 assay format
CHEMBL3689746 OBDepict OH N CH 3 N N H O H H F Ki = 0.193 nM 351.38 Cc1ccnc(CO)c1-c1ccc2cc(NC(=O)[C@@H]3C[C@@H]3F)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL4107478 OBDepict O NH N N N O H HO F F F IC50 = 0.2 nM 444.41 O=C(Nc1ccc(OC(F)(F)F)cc1)c1cnc(N2CC[C@@H](O)C2)c(-c2ccccn2)c1 Homo sapiens CHEMBL3888132 single protein format
CHEMBL4112072 OBDepict O N H N N N CH 3 O H HO Cl F F IC50 = 0.2 nM 474.9 Cc1ccncc1-c1cc(C(=O)Nc2ccc(OC(F)(F)Cl)cc2)cnc1N1CC[C@@H](O)C1 Homo sapiens CHEMBL3888133 single protein format
CHEMBL3967070 OBDepict O N H N N N N H O CH 3 OH F F F IC50 = 0.2 nM 433.39 CC1(O)CN(c2ncc(C(=O)Nc3ccc(OC(F)(F)F)cc3)cc2-c2ncc[nH]2)C1 Homo sapiens CHEMBL3888453 single protein format
CHEMBL3939040 OBDepict HO H N N N N N H O O F F F IC50 = 0.2 nM 459.43 O=C(Nc1ccc(OC(F)(F)F)cc1)c1cnc(N2CC[C@H](CO)C2)c(-c2cncnc2)c1 Homo sapiens CHEMBL3888133 single protein format
CHEMBL4109082 OBDepict O N H N N N N O NH 2 F F F F F F IC50 = 0.2 nM 512.41 N[C@]1(C(F)(F)F)CCN(c2ncc(C(=O)Nc3ccc(OC(F)(F)F)cc3)cc2-c2cncnc2)C1 Homo sapiens CHEMBL3888132 single protein format
CHEMBL3685184 OBDepict OH N CH 3 N N H O Ki = 0.2 nM 333.39 Cc1c(CO)cncc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689664 OBDepict F CH 3 N N N H N O Ki = 0.2 nM 398.44 Cc1ccc(F)cc1-c1cc2cnc(NC(=O)C3CC3)cc2c(-c2ccncc2)n1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685162 OBDepict HO Cl N N H O Ki = 0.2 nM 352.82 O=C(Nc1cc2ccc(-c3cc(CO)ccc3Cl)cc2cn1)C1CC1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689655 OBDepict F CH 3 N N N N H O Ki = 0.2 nM 398.44 Cc1ccc(F)cc1-c1cc2cnc(NC(=O)C3CC3)cc2c(-c2cccnc2)n1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689665 OBDepict F CH 3 N N N N N H H O Ki = 0.2 nM 387.42 Cc1ccc(F)cc1-c1cc2cnc(NC(=O)C3CC3)cc2c(-c2cc[nH]n2)n1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3685174 OBDepict O N H O CH 3 N N H O Ki = 0.2 nM 429.52 Cc1ccc(NC(=O)C2CCOCC2)cc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689653 OBDepict OH N N N H CH 3 F O Ki = 0.2 nM 351.38 Cc1ccc(F)cc1-c1cc2cnc(NC(=O)C3CC3)cc2c(CO)n1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL3689668 OBDepict F H 3 C N N OH H 3 C H 3 C N H O Ki = 0.2 nM 379.44 Cc1ccc(F)cc1-c1cc2cnc(NC(=O)C3CC3)cc2c(C(C)(C)O)n1 Homo sapiens CHEMBL3705971 single protein format
CHEMBL386051 OBDepict CH 3 S N H N N N CH 3 O Cl Cl Ki = 0.2 nM 443.36 CSc1cccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)c1 Homo sapiens CHEMBL1227835 single protein format
CHEMBL3689565 OBDepict O N H O O CH 3 N N H O Ki = 0.2 nM 431.49 Cc1ccc(NC(=O)C2COCCO2)cc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1 Homo sapiens CHEMBL3705971 single protein format