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P48067 | SC6A9_HUMAN | Sodium- and chloride-dependent glycine transporter 1 (SLC6A9)

3D structures mapped by conservation among orthologs



[ 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
CHEMBL4165362 OBDepict F H N H HN S O O N N H 3 C H Ki = 0.001 nM 440.54 Cn1cnc(S(=O)(=O)N2C[C@H](c3ccc(F)cc3)[C@@H](N[C@@H]3CCc4ccccc43)C2)c1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL4176089 OBDepict CH 3 N N S N O O H HN H O O O F F F Ki = 0.002 nM 476.48 Cn1cnc(S(=O)(=O)N2C[C@H](C3OCCCO3)[C@@H](Nc3cccc(OC(F)(F)F)c3)C2)c1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL4168242 OBDepict CH 3 N N S N O O H HN H O O O F F F Ki = 0.002 nM 490.5 Cn1cnc(S(=O)(=O)N2C[C@H](C3OCCCCO3)[C@@H](Nc3cccc(OC(F)(F)F)c3)C2)c1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL4163515 OBDepict F H N H N H S O O N N CH 3 F F F Ki = 0.002 nM 468.48 Cn1cnc(S(=O)(=O)N2C[C@H](c3ccc(F)cc3)[C@@H](Nc3cccc(C(F)(F)F)c3)C2)c1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL4161627 OBDepict F H N H N H S O O N N CH 3 O F F F F Ki = 0.002 nM 502.47 Cn1cnc(S(=O)(=O)N2C[C@H](c3ccc(F)cc3)[C@@H](Nc3ccc(F)c(OC(F)(F)F)c3)C2)c1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL4175977 OBDepict F H N H N H S O O N N N CH 3 F F F F Ki = 0.003 nM 487.45 Cn1cc(S(=O)(=O)N2C[C@H](c3ccc(F)cc3)[C@@H](Nc3ccc(F)c(C(F)(F)F)c3)C2)nn1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL4160468 OBDepict CH 3 N N S N O O H HN H H O O F F F Ki = 0.003 nM 474.51 Cn1cnc(S(=O)(=O)N2C[C@H]([C@H]3CCCCO3)[C@@H](Nc3cccc(OC(F)(F)F)c3)C2)c1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL4176431 OBDepict F N N H S O O N N CH 3 F F F Ki = 0.003 nM 468.48 Cn1cnc(S(=O)(=O)N2CC(Nc3cccc(C(F)(F)F)c3)C(c3ccc(F)cc3)C2)c1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL4174148 OBDepict F N N H S O O N N H 3 C Cl Ki = 0.003 nM 434.92 Cn1cnc(S(=O)(=O)N2CC(Nc3cccc(Cl)c3)C(c3ccc(F)cc3)C2)c1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL4159064 OBDepict F H N H N H S O O N N CH 3 O F F F Ki = 0.004 nM 484.48 Cn1cnc(S(=O)(=O)N2C[C@H](c3ccc(F)cc3)[C@@H](Nc3cccc(OC(F)(F)F)c3)C2)c1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL4172249 OBDepict F H N H N H S O O N N CH 3 N N F F F Ki = 0.005 nM 470.45 Cn1cnc(S(=O)(=O)N2C[C@H](c3ccc(F)cc3)[C@@H](Nc3cc(C(F)(F)F)ncn3)C2)c1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL4166232 OBDepict F N N H S O O N N CH 3 F F F F Ki = 0.005 nM 486.47 Cn1cnc(S(=O)(=O)N2CC(Nc3ccc(F)c(C(F)(F)F)c3)C(c3ccc(F)cc3)C2)c1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL4161927 OBDepict F H N H S O O O N N H 3 C O F F F Ki = 0.007 nM 499.49 Cn1cnc(S(=O)(=O)N2C[C@H](c3ccc(F)cc3)[C@@H](COc3cccc(OC(F)(F)F)c3)C2)c1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL4162798 OBDepict CH 3 N N S N O O N H F F F Ki = 0.008 nM 450.49 Cn1cnc(S(=O)(=O)N2CC(Nc3cccc(C(F)(F)F)c3)C(c3ccccc3)C2)c1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL4166963 OBDepict F H N H N H S O O N N CH 3 N F F F Ki = 0.008 nM 469.46 Cn1cnc(S(=O)(=O)N2C[C@H](c3ccc(F)cc3)[C@@H](Nc3cc(C(F)(F)F)ccn3)C2)c1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL4170790 OBDepict Cl N H N S O O N N H 3 C F Ki = 0.021 nM 434.92 Cn1cnc(S(=O)(=O)N2CC(Nc3cccc(Cl)c3)C(c3ccccc3F)C2)c1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL4171068 OBDepict CH 3 N N S N O O H HN H H O O F F F Ki = 0.024 nM 460.48 Cn1cnc(S(=O)(=O)N2C[C@H]([C@@H]3CCCO3)[C@@H](Nc3cccc(OC(F)(F)F)c3)C2)c1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL4172573 OBDepict F H N H S O O O N N CH 3 O F F F Ki = 0.029 nM 497.47 Cn1cnc(S(=O)(=O)N2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)c3cccc(OC(F)(F)F)c3)C2)c1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL4175269 OBDepict F N N H S O O N N H 3 C Cl Ki = 0.042 nM 434.92 Cn1cnc(S(=O)(=O)N2CC(Nc3cccc(Cl)c3)C(c3cccc(F)c3)C2)c1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL4177049 OBDepict F H N H S N H O O N N H 3 C O F F F Ki = 0.06 nM 498.5 Cn1cnc(S(=O)(=O)N2C[C@H](CNc3cccc(OC(F)(F)F)c3)[C@@H](c3ccc(F)cc3)C2)c1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL4169188 OBDepict CH 3 N N S N O O H H Ki = 0.093 nM 381.5 Cn1cnc(S(=O)(=O)N2C[C@H](c3ccccc3)[C@@H](Cc3ccccc3)C2)c1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL4173675 OBDepict F H N H O S O O N N CH 3 N N F F F Ki = 0.097 nM 471.44 Cn1cnc(S(=O)(=O)N2C[C@H](c3ccc(F)cc3)[C@@H](Oc3cc(C(F)(F)F)ncn3)C2)c1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL485356 OBDepict Cl Cl HN O N S O O N N N H 3 C IC50 = 0.1 nM 458.37 Cn1cc(S(=O)(=O)N2CC(CNC(=O)c3ccc(Cl)cc3Cl)(CC3CC3)C2)nn1 Homo sapiens CHEMBL993724 cell-based format
CHEMBL3974489 OBDepict CH 3 N H 3 C O F N H S O O N N CH 3 Ki < 0.1 nM 460.58 CN(C)CC(Cc1ccccc1)c1ccc(F)c(OCCNS(=O)(=O)c2cn(C)cn2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3903563 OBDepict H 3 C N CH 3 F O N H S O O N N CH 3 Ki < 0.1 nM 460.58 CN(C)CC(Cc1ccccc1)c1cc(OCCNS(=O)(=O)c2cnn(C)c2)ccc1F Homo sapiens CHEMBL3887852 assay format
CHEMBL3986911 OBDepict CH 3 N H 3 C O F F F N H S O O N N CH 3 Ki < 0.1 nM 510.58 CN(C)CC(Cc1cccc(C(F)(F)F)c1)c1cccc(OCCNS(=O)(=O)c2cn(C)cn2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3897585 OBDepict H 2 N N H S O O N N CH 3 Ki < 0.1 nM 384.51 Cn1cc(S(=O)(=O)NCc2cccc(C(CN)Cc3ccccc3)c2)cn1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3958198 OBDepict H 3 C N CH 3 O F F F N H S O O N N H 3 C Ki < 0.1 nM 510.58 CN(C)CC(Cc1cccc(C(F)(F)F)c1)c1cccc(OCCNS(=O)(=O)c2cnn(C)c2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL4115394 OBDepict CH 3 N O F HN S O O N N H 3 C Ki < 0.1 nM 458.56 CN1CC(Cc2ccccc2)(c2ccc(F)c(OCCNS(=O)(=O)c3cn(C)cn3)c2)C1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3949084 OBDepict CH 3 N CH 3 F O HN S O O N N H 3 C Ki < 0.1 nM 460.58 CN(C)CC(Cc1ccccc1)c1cc(OCCNS(=O)(=O)c2cn(C)cn2)ccc1F Homo sapiens CHEMBL3887852 assay format
CHEMBL4112557 OBDepict H 3 C N N S N H O O O HN Ki < 0.1 nM 426.54 Cn1cc(S(=O)(=O)NCCOc2cccc(C3(Cc4ccccc4)CNC3)c2)cn1 Homo sapiens CHEMBL3887852 assay format
CHEMBL4107214 OBDepict CH 3 N N S N H O O O HN Ki < 0.1 nM 426.54 Cn1cnc(S(=O)(=O)NCCOc2cccc(C3(Cc4ccccc4)CNC3)c2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3941470 OBDepict H 2 N O F F F N H S O O N N CH 3 Ki < 0.1 nM 482.53 Cn1cnc(S(=O)(=O)NCCOc2cccc(C(CN)Cc3cccc(C(F)(F)F)c3)c2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3898079 OBDepict CH 3 N CH 3 O F HN S O O N N H 3 C Ki < 0.1 nM 460.58 CN(C)CC(Cc1ccccc1)c1ccc(F)c(OCCNS(=O)(=O)c2cnn(C)c2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3973259 OBDepict CH 3 N H 3 C O N H S O O N N CH 3 Ki < 0.1 nM 442.59 CN(C)CC(Cc1ccccc1)c1cccc(OCCNS(=O)(=O)c2cnn(C)c2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL4111597 OBDepict CH 3 N O HN S O O N N H 3 C Ki < 0.1 nM 440.57 CN1CC(Cc2ccccc2)(c2cccc(OCCNS(=O)(=O)c3cn(C)cn3)c2)C1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3965993 OBDepict H 3 C N CH 3 Cl O N H S O O N N CH 3 Ki < 0.1 nM 477.03 CN(C)CC(Cc1ccccc1)c1cc(OCCNS(=O)(=O)c2cnn(C)c2)ccc1Cl Homo sapiens CHEMBL3887852 assay format
CHEMBL3924588 OBDepict CH 3 N O N H S O O N N CH 3 Ki < 0.1 nM 468.62 CN1CCCC(Cc2ccccc2)(c2cccc(OCCNS(=O)(=O)c3cn(C)cn3)c2)C1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3925754 OBDepict CH 3 N O N H S O O N N H 3 C Ki < 0.1 nM 468.62 CN1CCCC(Cc2ccccc2)(c2cccc(OCCNS(=O)(=O)c3cnn(C)c3)c2)C1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3895114 OBDepict H 2 N O F N H S O O N N H 3 C Ki < 0.1 nM 432.52 Cn1cnc(S(=O)(=O)NCCOc2cc(C(CN)Cc3ccccc3)ccc2F)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3905418 OBDepict H 2 N O N H S O O N N H 3 C Ki < 0.1 nM 414.53 Cn1cnc(S(=O)(=O)NCCOc2cccc(C(CN)Cc3ccccc3)c2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3946961 OBDepict O S NH O O N H Ki < 0.1 nM 414.57 O=S(=O)(CC1CC1)NCCOc1cccc(C2(Cc3ccccc3)CCNC2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3976171 OBDepict H 2 N O N H S O O N N CH 3 Ki < 0.1 nM 414.53 Cn1cc(S(=O)(=O)NCCOc2cccc(C(CN)Cc3ccccc3)c2)cn1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3955682 OBDepict CH 3 N N S NH O O O NH Ki < 0.1 nM 440.57 Cn1cnc(S(=O)(=O)NCCOc2cccc(C3(Cc4ccccc4)CCNC3)c2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3950091 OBDepict H 2 N O F N H S O O N N CH 3 Ki < 0.1 nM 432.52 Cn1cc(S(=O)(=O)NCCOc2cc(C(CN)Cc3ccccc3)ccc2F)cn1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3969479 OBDepict CH 3 N N S NH O O O N H Ki < 0.1 nM 440.57 Cn1cc(S(=O)(=O)NCCOc2cccc(C3(Cc4ccccc4)CCNC3)c2)cn1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3905417 OBDepict CH 3 N N S NH O O N H Ki < 0.1 nM 410.54 Cn1cc(S(=O)(=O)NCc2cccc(C3(Cc4ccccc4)CCNC3)c2)cn1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3979819 OBDepict CH 3 N O N H S O O N N H 3 C Ki < 0.1 nM 454.6 CN1CCC(Cc2ccccc2)(c2cccc(OCCNS(=O)(=O)c3cn(C)cn3)c2)C1 Homo sapiens CHEMBL3887852 assay format
CHEMBL4110360 OBDepict F N O HN S O O N N CH 3 Ki < 0.1 nM 472.59 Cn1cnc(S(=O)(=O)NCCOc2cccc(C3(Cc4ccccc4)CN(CCF)C3)c2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL4106869 OBDepict CH 3 O N O N H S O O N N H 3 C Ki < 0.1 nM 484.62 COCCN1CC(Cc2ccccc2)(c2cccc(OCCNS(=O)(=O)c3cn(C)cn3)c2)C1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3905260 OBDepict F N O NH S O O N N CH 3 Ki < 0.1 nM 486.61 Cn1cnc(S(=O)(=O)NCCOc2cccc(C3(Cc4ccccc4)CCN(CCF)C3)c2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3940213 OBDepict CH 3 N N S NH O O O N H 3 C H 3 C CH 3 Ki < 0.1 nM 510.7 Cn1cnc(S(=O)(=O)NCCOc2cccc(C3(Cc4ccccc4)CCN(CC(C)(C)C)C3)c2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3967662 OBDepict H 2 N O F F F N H S O O N N CH 3 Ki < 0.1 nM 482.53 Cn1cc(S(=O)(=O)NCCOc2cccc(C(CN)Cc3cccc(C(F)(F)F)c3)c2)cn1 Homo sapiens CHEMBL3887852 assay format
CHEMBL4160146 OBDepict F N N H S O O N N CH 3 N F F F Ki = 0.118 nM 469.46 Cn1cnc(S(=O)(=O)N2CC(Nc3ccnc(C(F)(F)F)c3)C(c3ccc(F)cc3)C2)c1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL4162199 OBDepict CH 3 N N S N O O N H Ki = 0.199 nM 382.49 Cn1cnc(S(=O)(=O)N2CC(Nc3ccccc3)C(c3ccccc3)C2)c1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL483938 OBDepict Cl Cl N H O N N S F O O N N N H 3 C IC50 = 0.31 nM 499.36 Cn1cc(S(=O)(=O)N2CC(CNC(=O)c3ccc(Cl)cc3Cl)(c3ncccc3F)C2)nn1 Homo sapiens CHEMBL993724 cell-based format
CHEMBL4165757 OBDepict F H N H S N H O O O N N H 3 C O F F F Ki = 0.36 nM 512.49 Cn1cnc(S(=O)(=O)N2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)Nc3cccc(OC(F)(F)F)c3)C2)c1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL379668 OBDepict H 3 C O Cl Cl O O N CH 3 CH 3 H O OH IC50 = 0.47 nM 450.32 COc1cc2c(c(Cl)c1Cl)C(=O)C(CCN(C)[C@@H](C)C(=O)O)(c1ccccc1)C2=O Homo sapiens CHEMBL867170 cell-based format
CHEMBL521463 OBDepict Cl Cl N H O N N F S O O N N N H 3 C IC50 = 0.65 nM 527.41 Cn1cc(S(=O)(=O)N2CCC(CNC(=O)c3ccc(Cl)cc3Cl)(c3ncccc3F)CC2)nn1 Homo sapiens CHEMBL993724 cell-based format
CHEMBL4174212 OBDepict CH 3 N N S N O O N H N F F F Ki = 0.766 nM 451.47 Cn1cnc(S(=O)(=O)N2CC(Nc3cccc(C(F)(F)F)c3)C(c3cccnc3)C2)c1 Homo sapiens CHEMBL4150719 cell-based format
CHEMBL4169829 OBDepict CH 3 N N S N H O O O H H N Ki = 0.8 nM 480.63 Cn1cnc(S(=O)(=O)NCCOc2ccc3c(c2)[C@@H](Cc2ccccc2)[C@@H](N2CCC2)CC3)c1 Homo sapiens CHEMBL4151684 cell-based format
CHEMBL4161906 OBDepict H 3 C N N S N H O O O H H H 2 N F F F Ki = 0.8 nM 508.57 Cn1cnc(S(=O)(=O)NCCOc2ccc3c(c2)[C@@H](Cc2cccc(C(F)(F)F)c2)[C@@H](N)CC3)c1 Homo sapiens CHEMBL4151684 cell-based format
CHEMBL4171521 OBDepict O S HN O N H H N Ki = 0.9 nM 465.66 O=S(=O)(CC1CC1)NC1CN(c2ccc3c(c2)[C@@H](Cc2ccccc2)[C@@H](N2CCC2)CC3)C1 Homo sapiens CHEMBL4151684 cell-based format
CHEMBL206851 OBDepict CH 3 O Cl Cl O O N H 3 C F O HO IC50 = 0.95 nM 454.28 COc1cc2c(c(Cl)c1Cl)C(=O)C(CCN(C)CC(=O)O)(c1ccc(F)cc1)C2=O Homo sapiens CHEMBL867170 cell-based format
CHEMBL4228975 OBDepict CH 3 N H 3 C NH O CH 3 CH 3 IC50 = 1.0 nM 376.54 Cc1cccc(C)c1C(=O)NC(c1ccccc1)C12CCC(CC1)N2C(C)C Homo sapiens CHEMBL4221489 cell-based format
CHEMBL3912223 OBDepict O N H N S S O O N S Cl N F F F IC50 = 1.0 nM 515.0 O=C(C1CCS(=O)(=O)CC1)N1CCN(c2nnc(C(F)(F)F)s2)C[C@H]1c1ccc(Cl)s1 Homo sapiens CHEMBL3887843 cell-based format
CHEMBL4225587 OBDepict H 3 C N N H O S H 3 C CH 3 O O IC50 = 1.0 nM 480.67 Cc1cccc(C)c1C(=O)NC(c1ccc(S(=O)(=O)CC2CC2)cc1)C12CCC(CC1)CN2C Homo sapiens CHEMBL4221489 cell-based format
CHEMBL4224734 OBDepict H 3 C N N H O N CH 3 CH 3 IC50 = 1.0 nM 363.51 Cc1cccc(C)c1C(=O)NC(c1ccncc1)C12CCC(CC1)CN2C Homo sapiens CHEMBL4221489 cell-based format
CHEMBL4110361 OBDepict H 3 C O N O O N H S O O Ki < 1.0 nM 472.61 CCOC(=O)N1CC(Cc2ccccc2)(c2cccc(OCCNS(=O)(=O)CC3CC3)c2)C1 Homo sapiens CHEMBL3887852 assay format
CHEMBL4226364 OBDepict H 3 C O N H N H 3 C O H 3 C CH 3 IC50 = 1.0 nM 366.51 Cc1ccc(C(NC(=O)c2c(C)cccc2C)C23CCC(CC2)CN3C)o1 Homo sapiens CHEMBL4221489 cell-based format
CHEMBL3957700 OBDepict CH 3 N N S NH O O N O Ki < 1.0 nM 454.6 Cn1cc(S(=O)(=O)NCc2cccc(C(Cc3ccccc3)CN3CCOCC3)c2)cn1 Homo sapiens CHEMBL3887852 assay format
CHEMBL4114653 OBDepict H 3 C O N O O N H S O O N N H 3 C Ki < 1.0 nM 498.61 CCOC(=O)N1CC(Cc2ccccc2)(c2cccc(OCCNS(=O)(=O)c3cn(C)cn3)c2)C1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3933497 OBDepict CH 3 N N H S O O N N CH 3 Ki < 1.0 nM 424.57 CN1CCC(Cc2ccccc2)(c2cccc(CNS(=O)(=O)c3cnn(C)c3)c2)C1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3904082 OBDepict CH 3 N N S NH O O O N O F F Ki < 1.0 nM 518.59 Cn1cnc(S(=O)(=O)NCCOc2cccc(C3(Cc4ccccc4)CCN(C(=O)C(F)F)C3)c2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3933419 OBDepict O S NH O N H Ki < 1.0 nM 384.55 O=S(=O)(CC1CC1)NCc1cccc(C2(Cc3ccccc3)CCNC2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL4107772 OBDepict CH 3 N O F N S CH 3 O O N N H 3 C Ki < 1.0 nM 472.59 CN1CC(Cc2ccccc2)(c2ccc(F)c(OCCN(C)S(=O)(=O)c3cn(C)cn3)c2)C1 Homo sapiens CHEMBL3887852 assay format
CHEMBL4113326 OBDepict CH 3 N N S N H O O O N F F F Ki < 1.0 nM 508.57 Cn1cnc(S(=O)(=O)NCCOc2cccc(C3(Cc4ccccc4)CN(CC(F)(F)F)C3)c2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3972278 OBDepict H 2 N N H S O O N N H 3 C Ki < 1.0 nM 384.51 Cn1cnc(S(=O)(=O)NCc2cccc(C(CN)Cc3ccccc3)c2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3899990 OBDepict H 2 N O Cl N H S O O N N H 3 C Ki < 1.0 nM 448.98 Cn1cnc(S(=O)(=O)NCCOc2cccc(C(CN)Cc3cccc(Cl)c3)c2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3943744 OBDepict CH 3 N H 3 C O N H S O O N N CH 3 Ki < 1.0 nM 442.59 CN(C)CC(Cc1ccccc1)c1cccc(OCCNS(=O)(=O)c2cn(C)cn2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL4226039 OBDepict O N H Cl H Cl N CH 3 IC50 = 1.0 nM 403.35 CN1CC2CCC1([C@H](NC(=O)c1cccc(Cl)c1Cl)c1ccccc1)CC2 Homo sapiens CHEMBL4221489 cell-based format
CHEMBL3961389 OBDepict H 3 C N N S HN O O O N CH 3 CH 3 Ki < 1.0 nM 482.65 CC(C)N1CCC(Cc2ccccc2)(c2cccc(OCCNS(=O)(=O)c3cn(C)cn3)c2)C1 Homo sapiens CHEMBL3887852 assay format
CHEMBL4111314 OBDepict O S NH O O N H Ki < 1.0 nM 400.54 O=S(=O)(CC1CC1)NCCOc1cccc(C2(Cc3ccccc3)CNC2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3960089 OBDepict H 2 N O Cl N H S O O N N CH 3 Ki < 1.0 nM 448.98 Cn1cc(S(=O)(=O)NCCOc2cccc(C(CN)Cc3ccc(Cl)cc3)c2)cn1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3958766 OBDepict CH 3 N H 3 C N H S O O N N CH 3 Ki < 1.0 nM 412.56 CN(C)CC(Cc1ccccc1)c1cccc(CNS(=O)(=O)c2cn(C)cn2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL4113699 OBDepict F F N O HN S O O N N CH 3 Ki < 1.0 nM 490.58 Cn1cnc(S(=O)(=O)NCCOc2cccc(C3(Cc4ccccc4)CN(CC(F)F)C3)c2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3985832 OBDepict CH 3 N N S NH O O O N Ki < 1.0 nM 468.62 Cn1cc(S(=O)(=O)NCCOc2cccc(C(Cc3ccccc3)CN3CCCC3)c2)cn1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3898732 OBDepict O N H O N H S O O N N H 3 C Ki < 1.0 nM 454.55 Cn1cnc(S(=O)(=O)NCCOc2cccc(C3(Cc4ccccc4)CNC(=O)C3)c2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3971077 OBDepict H 2 N O F F N H S O O N N H 3 C Ki < 1.0 nM 450.51 Cn1cnc(S(=O)(=O)NCCOc2cccc(C(CN)Cc3cc(F)cc(F)c3)c2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3945946 OBDepict O N H O N H S O O N N CH 3 Ki < 1.0 nM 454.55 Cn1cc(S(=O)(=O)NCCOc2cccc(C3(Cc4ccccc4)CNC(=O)C3)c2)cn1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3938130 OBDepict CH 3 N N S NH O O O N Ki < 1.0 nM 468.62 Cn1cnc(S(=O)(=O)NCCOc2cccc(C(Cc3ccccc3)CN3CCCC3)c2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3913494 OBDepict F H N N O N O S F F F O O IC50 = 1.0 nM 475.46 O=C(C1CCS(=O)(=O)CC1)N1CCN(c2cc(C(F)(F)F)on2)C[C@H]1c1ccc(F)cc1 Homo sapiens CHEMBL3887843 cell-based format
CHEMBL3897369 OBDepict H 2 N O Cl N H S O O N N CH 3 Ki < 1.0 nM 448.98 Cn1cc(S(=O)(=O)NCCOc2cccc(C(CN)Cc3cccc(Cl)c3)c2)cn1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3915372 OBDepict H 2 N O F F N H S O O N N CH 3 Ki < 1.0 nM 450.51 Cn1cc(S(=O)(=O)NCCOc2cccc(C(CN)Cc3cc(F)cc(F)c3)c2)cn1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3915281 OBDepict CH 3 N N S HN O O O N Ki < 1.0 nM 454.6 Cn1cc(S(=O)(=O)NCCOc2cccc(C(Cc3ccccc3)CN3CCC3)c2)cn1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3943526 OBDepict CH 3 N N S NH O O N Ki < 1.0 nM 424.57 Cn1cc(S(=O)(=O)NCc2cccc(C(Cc3ccccc3)CN3CCC3)c2)cn1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3895846 OBDepict H 3 C N O N S H 3 C O O N N CH 3 Ki < 1.0 nM 468.62 CN1CCC(Cc2ccccc2)(c2cccc(OCCN(C)S(=O)(=O)c3cn(C)cn3)c2)C1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3934775 OBDepict CH 3 N H 3 C N H S O O N N CH 3 Ki < 1.0 nM 412.56 CN(C)CC(Cc1ccccc1)c1cccc(CNS(=O)(=O)c2cnn(C)c2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL3973811 OBDepict H 2 N F O N H S O O N N H 3 C Ki < 1.0 nM 432.52 Cn1cnc(S(=O)(=O)NCCOc2ccc(F)c(C(CN)Cc3ccccc3)c2)c1 Homo sapiens CHEMBL3887852 assay format
CHEMBL4228859 OBDepict O N H CH 3 H 3 C H N H 3 C IC50 = 1.0 nM 362.52 Cc1cccc(C)c1C(=O)N[C@H](c1ccccc1)C12CCC(CC1)CN2C Homo sapiens CHEMBL4221489 cell-based format