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Q99500 | S1PR3_HUMAN | Sphingosine 1-phosphate receptor 3 (S1PR3)

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
CHEMBL225155 OBDepict H 3 C OH H NH 2 H O P O OH OH IC50 = 0.04 nM 379.48 CCCCCCCCCCCCC/C=C/[C@@H](O)[C@@H](N)COP(=O)(O)O Homo sapiens CHEMBL806183 cell-based format
CHEMBL473156 OBDepict O N H NH 2 H 3 C O P O OH OH O IC50 = 0.36 nM 436.45 C[C@](N)(COP(=O)(O)O)C(=O)Nc1ccc(OCCCCCc2ccccc2)cc1 Homo sapiens CHEMBL980649 single protein format
CHEMBL432067 OBDepict H 3 C NH 2 O P O OH HO IC50 = 0.71 nM 357.43 CCCCCCCCc1ccc(CCC(N)COP(=O)(O)O)cc1 Homo sapiens CHEMBL806183 cell-based format
CHEMBL119349 OBDepict OH P O OH N H IC50 = 0.91 nM 355.46 O=P(O)(O)CCCNCCCCCCCCCCc1ccccc1 Homo sapiens CHEMBL806180 cell-based format
CHEMBL333335 OBDepict CH 3 O N H P O OH OH IC50 = 1.1 nM 371.46 CCCCCCCCCOc1ccc(CNCCCP(=O)(O)O)cc1 Homo sapiens CHEMBL806181 cell-based format
CHEMBL119873 OBDepict H 3 C O F N H P O OH OH IC50 = 1.2 nM 375.42 CCCCCCCCOc1ccc(CNCCCP(=O)(O)O)cc1F Homo sapiens CHEMBL806181 cell-based format
CHEMBL3655408 OBDepict CH 3 CH 3 O N N H O CH 3 H 3 C F F IC50 = 1.2 nM 490.59 CC(C)COc1ccc2c(C(=O)NCc3ccc(F)c(F)c3)c(C(C)C)n(Cc3ccccc3)c2c1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL117031 OBDepict H 2 N P O OH OH IC50 = 2.0 nM 355.46 NC(CCCCCCCCCCc1ccccc1)CCP(=O)(O)O Homo sapiens CHEMBL806180 cell-based format
CHEMBL184879 OBDepict CH 3 N H P O OH OH IC50 = 2.7 nM 381.5 CCCCCCCCCc1ccc(C2CCC(CCP(=O)(O)O)N2)cc1 Homo sapiens CHEMBL833011 cell-based format
CHEMBL118860 OBDepict H 3 C N H P O OH OH IC50 = 2.7 nM 355.46 CCCCCCCCCc1ccc(CNCCCP(=O)(O)O)cc1 Homo sapiens CHEMBL806180 cell-based format
CHEMBL117973 OBDepict CH 3 N H P O OH OH IC50 = 2.7 nM 349.5 CCCCCCCCCCCCCCCNCCCP(=O)(O)O Homo sapiens CHEMBL806180 cell-based format
CHEMBL118265 OBDepict CH 3 N H P O OH OH IC50 = 2.8 nM 321.44 CCCCCCCCCCCCCNCCCP(=O)(O)O Homo sapiens CHEMBL806180 cell-based format
CHEMBL3655407 OBDepict H 3 C O N N H O H 3 C CH 3 F F IC50 = 3.0 nM 490.59 CCCCOc1ccc2c(C(=O)NCc3ccc(F)c(F)c3)c(C(C)C)n(Cc3ccccc3)c2c1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3659686 OBDepict F F HN O N CH 3 H 3 C O N IC50 = 3.0 nM 503.59 CC(C)c1c(C(=O)NCc2ccc(F)c(F)c2)c2ccc(OC3CCCC3)cc2n1Cc1ccccn1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3741414 OBDepict CH 3 O H H 2 N O P O OH HO IC50 = 3.0 nM 399.47 CCCCCCCCOc1ccc([C@@H]2CC[C@](N)(COP(=O)(O)O)C2)cc1 Homo sapiens CHEMBL3744620 cell-based format
CHEMBL3655411 OBDepict F F HN O N CH 3 H 3 C O IC50 = 3.0 nM 502.61 CC(C)c1c(C(=O)NCc2ccc(F)c(F)c2)c2ccc(OC3CCCC3)cc2n1Cc1ccccc1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL334213 OBDepict H 3 C N H P O OH OH IC50 = 3.6 nM 335.47 CCCCCCCCCCCCCCNCCCP(=O)(O)O Homo sapiens CHEMBL806180 cell-based format
CHEMBL474688 OBDepict H 3 C O F N H O H 2 N CH 3 O P O OH OH IC50 = 3.6 nM 420.42 CCCCCCCCOc1ccc(NC(=O)[C@@](C)(N)COP(=O)(O)O)c(F)c1 Homo sapiens CHEMBL1029036 single protein format
CHEMBL372066 OBDepict CH 3 H 3 C H 3 C O N N N O HO IC50 = 3.86 nM 405.5 CCC(C)(C)c1ccc(-c2nc(-c3ccc(CN4CC(C(=O)O)C4)cc3)no2)cc1 Homo sapiens CHEMBL880431 cell-based format
CHEMBL3655526 OBDepict CH 3 O O N N H O H 3 C CH 3 F F IC50 = 4.0 nM 518.6 CCCCOC(=O)c1ccc2c(C(=O)NCc3ccc(F)c(F)c3)c(C(C)C)n(Cc3ccccc3)c2c1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3655417 OBDepict F F HN O N CH 3 H 3 C O O H 3 C H 3 C H 3 C IC50 = 4.0 nM 518.6 CC(C)c1c(C(=O)NCc2ccc(F)c(F)c2)c2ccc(OC(=O)C(C)(C)C)cc2n1Cc1ccccc1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL325193 OBDepict H 3 C N H P O OH OH IC50 = 4.3 nM 355.46 CCCCCCCCc1ccc(CCNCCCP(=O)(O)O)cc1 Homo sapiens CHEMBL806180 cell-based format
CHEMBL181597 OBDepict H 3 C N H H H P O OH OH IC50 = 4.7 nM 395.52 CCCCCCCCCc1ccc(CN[C@H]2CCC[C@H](P(=O)(O)O)C2)cc1 Homo sapiens CHEMBL833011 cell-based format
CHEMBL119413 OBDepict H 3 C O Cl N H P O OH OH IC50 = 4.9 nM 391.88 CCCCCCCCOc1ccc(CNCCCP(=O)(O)O)cc1Cl Homo sapiens CHEMBL806181 cell-based format
CHEMBL3651714 OBDepict CH 3 O N N H O CH 3 H 3 C F F IC50 = 5.0 nM 476.57 CCCOc1ccc2c(C(=O)NCc3ccc(F)c(F)c3)c(C(C)C)n(Cc3ccccc3)c2c1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3655472 OBDepict F F HN O N CH 3 H 3 C O N N S IC50 = 5.0 nM 518.59 CC(C)c1c(C(=O)NCc2ccc(F)c(F)c2)c2ccc(Oc3nccs3)cc2n1Cc1ccccn1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3655475 OBDepict F F HN O N CH 3 H 3 C O N IC50 = 5.0 nM 503.59 CC(C)c1c(C(=O)NCc2ccc(F)c(F)c2)c2ccc(OC3CCCC3)cc2n1Cc1cccnc1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3659689 OBDepict CH 3 CH 3 O N N H O N CH 3 H 3 C F F IC50 = 5.0 nM 491.58 CC(C)COc1ccc2c(C(=O)NCc3ccc(F)c(F)c3)c(C(C)C)n(Cc3ccccn3)c2c1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL187588 OBDepict H 3 C H HN H P O HO OH IC50 = 5.2 nM 375.53 CCCCCCCCCCCCCC[C@H]1CC[C@H](CCP(=O)(O)O)N1 Homo sapiens CHEMBL833011 cell-based format
CHEMBL474689 OBDepict CH 3 O N N H H 2 N H 3 C O P O OH HO IC50 = 5.3 nM 425.47 CCCCCCCCOc1ccc(-c2c[nH]c([C@@](C)(N)COP(=O)(O)O)n2)cc1 Homo sapiens CHEMBL1029036 single protein format
CHEMBL473269 OBDepict CH 3 O F N N H H 2 N H 3 C O P O OH HO IC50 = 5.8 nM 443.46 CCCCCCCCOc1ccc(-c2c[nH]c([C@@](C)(N)COP(=O)(O)O)n2)cc1F Homo sapiens CHEMBL1029036 single protein format
CHEMBL515921 OBDepict CH 3 O F N H O NH 2 CH 3 O P O HO OH IC50 = 5.9 nM 420.42 CCCCCCCCOc1ccc(NC(=O)[C@@](C)(N)COP(=O)(O)O)cc1F Homo sapiens CHEMBL1029036 single protein format
CHEMBL475495 OBDepict CH 3 O N H O NH 2 CH 3 O P O HO OH IC50 = 5.9 nM 402.43 CCCCCCCCOc1ccc(NC(=O)[C@@](C)(N)COP(=O)(O)O)cc1 Homo sapiens CHEMBL1029036 single protein format
CHEMBL3651715 OBDepict CH 3 O CH 3 N N H O CH 3 H 3 C F F IC50 = 6.0 nM 476.57 CC(C)Oc1ccc2c(C(=O)NCc3ccc(F)c(F)c3)c(C(C)C)n(Cc3ccccc3)c2c1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3655422 OBDepict F F HN O N CH 3 H 3 C O O IC50 = 6.0 nM 504.58 CC(C)c1c(C(=O)NCc2ccc(F)c(F)c2)c2ccc(OC3CCCO3)cc2n1Cc1ccccc1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3655414 OBDepict F F HN O N CH 3 H 3 C O O IC50 = 6.0 nM 504.58 CC(C)c1c(C(=O)NCc2ccc(F)c(F)c2)c2ccc(OC3CCOC3)cc2n1Cc1ccccc1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL470511 OBDepict CH 3 NH 2 N N O H P O OH HO O IC50 = 6.0 nM 459.48 C[C@](N)(COP(=O)(O)O)c1nc(-c2ccc(OCCCCCc3ccccc3)cc2)c[nH]1 Homo sapiens CHEMBL980649 single protein format
CHEMBL331054 OBDepict H 3 C O CH 3 N H P O OH OH IC50 = 6.0 nM 371.46 CCCCCCCCOc1ccc(CNCCCP(=O)(O)O)cc1C Homo sapiens CHEMBL806181 cell-based format
CHEMBL1161691 OBDepict CH 3 NH 2 O OH P HO HO OH H IC50 = 6.3 nM 389.47 CCCCCCCCc1ccc(CCC(N)(CO)CO[PH](O)(O)O)cc1 Homo sapiens CHEMBL833011 cell-based format
CHEMBL366208 OBDepict H 3 C NH 2 O OH P O OH HO IC50 = 6.3 nM 387.46 CCCCCCCCc1ccc(CC[C@](N)(CO)COP(=O)(O)O)cc1 Homo sapiens CHEMBL1657526 cell-based format
CHEMBL117130 OBDepict H 3 C O H 2 N P OH O OH OH IC50 = 6.3 nM 373.43 CCCCCCCCc1ccc(CCC(N)(CO)OP(=O)(O)O)cc1 Homo sapiens CHEMBL806180 cell-based format
CHEMBL114606 OBDepict H 3 C NH 2 O OH P O OH HO IC50 = 6.3 nM 387.46 CCCCCCCCc1ccc(CCC(N)(CO)COP(=O)(O)O)cc1 Homo sapiens CHEMBL806183 cell-based format
CHEMBL3655412 OBDepict H 3 C O O N N H O H 3 C CH 3 F F IC50 = 6.5 nM 492.57 COCCOc1ccc2c(C(=O)NCc3ccc(F)c(F)c3)c(C(C)C)n(Cc3ccccc3)c2c1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3655423 OBDepict CH 3 O O N N H O CH 3 H 3 C F F IC50 = 7.0 nM 490.55 CCOC(=O)c1ccc2c(C(=O)NCc3ccc(F)c(F)c3)c(C(C)C)n(Cc3ccccc3)c2c1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3655443 OBDepict CH 3 H N O N HN O N CH 3 H 3 C F F IC50 = 7.0 nM 516.59 CC[C@H]1COC(c2ccc3c(C(=O)NCc4ccc(F)c(F)c4)c(C(C)C)n(Cc4ccccn4)c3c2)=N1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3655481 OBDepict F F N H O N H 3 C CH 3 O N IC50 = 7.0 nM 489.57 CC(C)c1c(C(=O)NCc2ccc(F)c(F)c2)c2ccc(OC3CCC3)cc2n1Cc1cccnc1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3659690 OBDepict H 3 C O N N H O N H 3 C CH 3 F F IC50 = 8.0 nM 491.58 CCCCOc1ccc2c(C(=O)NCc3ccc(F)c(F)c3)c(C(C)C)n(Cc3ccccn3)c2c1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL187692 OBDepict CH 3 N H P O HO CH 3 IC50 = 8.2 nM 373.56 CCCCCCCCCCCCCC1CCCC(CCP(C)(=O)O)N1 Homo sapiens CHEMBL833011 cell-based format
CHEMBL332373 OBDepict H 3 C O N H P O OH OH IC50 = 8.5 nM 357.43 CCCCCCCCOc1ccc(CNCCCP(=O)(O)O)cc1 Homo sapiens CHEMBL806181 cell-based format
CHEMBL3655531 OBDepict CH 3 O O N N H O CH 3 H 3 C IC50 = 9.0 nM 454.57 CCOC(=O)c1ccc2c(C(=O)NCc3ccccc3)c(C(C)C)n(Cc3ccccc3)c2c1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3655527 OBDepict F F HN O N CH 3 H 3 C O N O IC50 = 9.0 nM 505.57 CC(C)c1c(C(=O)NCc2ccc(F)c(F)c2)c2ccc(OC3CCCO3)cc2n1Cc1ccccn1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL185100 OBDepict H 3 C N CH 3 P O OH OH IC50 = 9.8 nM 349.5 CCCCCCCCCCCCCCN(C)CCCP(=O)(O)O Homo sapiens CHEMBL833011 cell-based format
CHEMBL3655502 OBDepict O N H N H 3 C CH 3 N O O F F IC50 = 10.0 nM 493.55 CC(C)c1c(C(=O)NCc2ccc(F)c(F)c2)c2ccc(OC3CCCC3)cc2n1Cc1ncco1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3655496 OBDepict CH 3 O CH 3 N N H O N CH 3 H 3 C F F IC50 = 10.0 nM 477.56 CC(C)Oc1ccc2c(C(=O)NCc3ccc(F)c(F)c3)c(C(C)C)n(Cc3ccccn3)c2c1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL119760 OBDepict H 3 C H 2 N P O OH OH IC50 = 10.0 nM 321.44 CCCCCCCCCCCCCC(N)CCP(=O)(O)O Homo sapiens CHEMBL806180 cell-based format
CHEMBL3655510 OBDepict CH 3 H 3 C N N H O N O F N F IC50 = 10.0 nM 512.56 CC(C)c1c(C(=O)NCc2ccc(F)c(F)c2)c2ccc(Oc3cccnc3)cc2n1Cc1ccccn1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL475253 OBDepict O N H NH 2 H 3 C O P O OH OH O IC50 = 10.2 nM 498.52 C[C@](N)(COP(=O)(O)O)C(=O)Nc1ccc(OCCCCc2ccc(-c3ccccc3)cc2)cc1 Homo sapiens CHEMBL980649 single protein format
CHEMBL3655513 OBDepict CH 3 O O N N H O CH 3 H 3 C F F IC50 = 12.0 nM 476.52 COC(=O)c1ccc2c(C(=O)NCc3ccc(F)c(F)c3)c(C(C)C)n(Cc3ccccc3)c2c1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL194419 OBDepict CH 3 H 3 C O N N N O HO IC50 = 12.0 nM 391.47 CC(C)Cc1ccc(-c2nc(-c3ccc(CN4CC(C(=O)O)C4)cc3)no2)cc1 Homo sapiens CHEMBL1657526 cell-based format
CHEMBL3655525 OBDepict H 3 C CH 3 O O N N H O CH 3 H 3 C F F IC50 = 12.0 nM 518.6 CC(C)COC(=O)c1ccc2c(C(=O)NCc3ccc(F)c(F)c3)c(C(C)C)n(Cc3ccccc3)c2c1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3655489 OBDepict F F N H O N H 3 C CH 3 NH IC50 = 13.0 nM 487.59 CC(C)c1c(C(=O)NCc2ccc(F)c(F)c2)c2ccc(NC3CCC3)cc2n1Cc1ccccc1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL119116 OBDepict H 3 C O Cl Cl N H P O OH OH IC50 = 13.0 nM 426.32 CCCCCCCCOc1c(Cl)cc(CNCCCP(=O)(O)O)cc1Cl Homo sapiens CHEMBL806181 cell-based format
CHEMBL119562 OBDepict H 3 C N H P O OH OH IC50 = 13.0 nM 307.42 CCCCCCCCCCCCNCCCP(=O)(O)O Homo sapiens CHEMBL806180 cell-based format
CHEMBL3655470 OBDepict F N NH O N H 3 C CH 3 N O IC50 = 13.0 nM 486.59 CC(C)c1c(C(=O)NCc2cncc(F)c2)c2ccc(OC3CCCC3)cc2n1Cc1ccccn1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3655418 OBDepict CH 3 O O N N H O CH 3 H 3 C F F IC50 = 14.0 nM 476.52 CC(=O)Oc1ccc2c(C(=O)NCc3ccc(F)c(F)c3)c(C(C)C)n(Cc3ccccc3)c2c1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3655420 OBDepict CH 3 CH 3 O O N N H O CH 3 H 3 C F F IC50 = 14.0 nM 504.58 CC(C)C(=O)Oc1ccc2c(C(=O)NCc3ccc(F)c(F)c3)c(C(C)C)n(Cc3ccccc3)c2c1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL119110 OBDepict CH 3 NH 2 P O OH OH IC50 = 14.0 nM 335.47 CCCCCCCCCCCCCCC(N)CCP(=O)(O)O Homo sapiens CHEMBL806180 cell-based format
CHEMBL119233 OBDepict H 3 C N H P O OH OH IC50 = 14.0 nM 355.46 CCCCCCCc1ccc(CCCNCCCP(=O)(O)O)cc1 Homo sapiens CHEMBL806180 cell-based format
CHEMBL3655455 OBDepict CH 3 O CH 3 N N H O N OH H 3 C F F IC50 = 15.0 nM 479.53 CC(C)Oc1ccc2c(C(=O)NCc3ccc(F)c(F)c3)c(C(C)O)n(Cc3ccccn3)c2c1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL115738 OBDepict H 3 C N H P O OH OH IC50 = 15.0 nM 363.52 CCCCCCCCCCCCCCCCNCCCP(=O)(O)O Homo sapiens CHEMBL806180 cell-based format
CHEMBL3659691 OBDepict CH 3 O N N H O N CH 3 H 3 C F F IC50 = 15.0 nM 477.56 CCCOc1ccc2c(C(=O)NCc3ccc(F)c(F)c3)c(C(C)C)n(Cc3ccccn3)c2c1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3655476 OBDepict CH 3 O CH 3 N N H O CH 3 H 3 C N F F IC50 = 15.0 nM 477.56 CC(C)Oc1ccc2c(C(=O)NCc3ccc(F)c(F)c3)c(C(C)C)n(Cc3cccnc3)c2c1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3655466 OBDepict F F HN O N CH 3 H 3 C O N S IC50 = 16.0 nM 517.6 CC(C)c1c(C(=O)NCc2ccc(F)c(F)c2)c2ccc(Oc3nccs3)cc2n1Cc1ccccc1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL363008 OBDepict CH 3 N P HO O OH HO IC50 = 17.0 nM 377.51 CCCCCCCCCCCCCCN1CCC(C(O)P(=O)(O)O)C1 Homo sapiens CHEMBL833011 cell-based format
CHEMBL3655438 OBDepict CH 3 H N O N HN O CH 3 H 3 C F F IC50 = 17.0 nM 515.6 CC[C@H]1COC(c2ccc3c(C(=O)NCc4ccc(F)c(F)c4)c(C(C)C)n(Cc4ccccc4)c3c2)=N1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3651727 OBDepict OH N N H O N F F IC50 = 17.0 nM 461.51 O=C(NCc1ccc(F)c(F)c1)c1c(C2CCCC2)n(Cc2ccccn2)c2ccc(O)cc12 Homo sapiens CHEMBL3705089 single protein format
CHEMBL3655474 OBDepict F F HN O N CH 3 H 3 C O N N S IC50 = 17.0 nM 518.59 CC(C)c1c(C(=O)NCc2ccc(F)c(F)c2)c2ccc(Oc3nccs3)cc2n1Cc1cccnc1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3655448 OBDepict H 3 C H N O N NH O N H 3 C CH 3 F F IC50 = 18.0 nM 516.59 CC[C@H]1COC(c2ccc3c(C(=O)NCc4cc(F)cc(F)c4)c(C(C)C)n(Cc4ccccn4)c3c2)=N1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL184349 OBDepict CH 3 N P O OH HO IC50 = 18.0 nM 367.47 CCCCCCCCCc1ccc(CN2CCC(P(=O)(O)O)C2)cc1 Homo sapiens CHEMBL833011 cell-based format
CHEMBL115554 OBDepict CH 3 H 2 N H P HO H O OH HO IC50 = 18.0 nM 371.46 CCCCCCCCc1ccc(CC[C@@H](N)C[C@@H](O)P(=O)(O)O)cc1 Homo sapiens CHEMBL806183 cell-based format
CHEMBL3659685 OBDepict F F HN O N CH 3 H 3 C O N O IC50 = 19.0 nM 505.57 CC(C)c1c(C(=O)NCc2ccc(F)c(F)c2)c2ccc(OC3CCOC3)cc2n1Cc1ccccn1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3651713 OBDepict CH 3 O N N H O CH 3 H 3 C F F IC50 = 19.0 nM 462.54 CCOc1ccc2c(C(=O)NCc3ccc(F)c(F)c3)c(C(C)C)n(Cc3ccccc3)c2c1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL184237 OBDepict H 3 C N OH P O OH OH IC50 = 19.0 nM 363.48 CCCCCCCCCCCCCCN1CCC(O)(P(=O)(O)O)C1 Homo sapiens CHEMBL833011 cell-based format
CHEMBL3655493 OBDepict F F N H O N H 3 C CH 3 NH IC50 = 20.0 nM 487.59 CC(C)c1c(C(=O)NCc2cc(F)cc(F)c2)c2ccc(NC3CCC3)cc2n1Cc1ccccc1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3655419 OBDepict CH 3 O O N N H O CH 3 H 3 C F F IC50 = 20.0 nM 490.55 CCC(=O)Oc1ccc2c(C(=O)NCc3ccc(F)c(F)c3)c(C(C)C)n(Cc3ccccc3)c2c1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL515917 OBDepict CH 3 NH 2 N N O H P O OH HO O IC50 = 20.0 nM 445.46 C[C@](N)(COP(=O)(O)O)c1nc(-c2ccc(OCCCCc3ccccc3)cc2)c[nH]1 Homo sapiens CHEMBL980649 single protein format
CHEMBL514170 OBDepict H N N H 2 N H 3 C O P O OH HO O IC50 = 20.0 nM 479.47 C[C@](N)(COP(=O)(O)O)c1nc(-c2ccc(OCc3ccc(-c4ccccc4)cc3)cc2)c[nH]1 Homo sapiens CHEMBL980649 single protein format
CHEMBL3655509 OBDepict CH 3 H 3 C N N H O N O N F F IC50 = 21.0 nM 512.56 CC(C)c1c(C(=O)NCc2ccc(F)c(F)c2)c2ccc(Oc3ccccn3)cc2n1Cc1ccccn1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3655456 OBDepict H 3 C O CH 3 N N H O N O CH 3 F F IC50 = 21.0 nM 477.51 CC(=O)c1c(C(=O)NCc2ccc(F)c(F)c2)c2ccc(OC(C)C)cc2n1Cc1ccccn1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3655528 OBDepict CH 3 O N N N H O CH 3 H 3 C F F IC50 = 21.0 nM 475.54 CO/N=C/c1ccc2c(C(=O)NCc3ccc(F)c(F)c3)c(C(C)C)n(Cc3ccccc3)c2c1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL119256 OBDepict CH 3 N H P O OH OH IC50 = 21.0 nM 341.43 CCCCCCCCc1ccc(CNCCCP(=O)(O)O)cc1 Homo sapiens CHEMBL806181 cell-based format
CHEMBL473563 OBDepict O N H NH 2 H 3 C O P O OH OH O IC50 = 21.1 nM 456.44 C[C@](N)(COP(=O)(O)O)C(=O)Nc1ccc(OCc2ccc(-c3ccccc3)cc2)cc1 Homo sapiens CHEMBL980649 single protein format
CHEMBL3655478 OBDepict F F N H O N H 3 C CH 3 N IC50 = 22.0 nM 495.57 CC(C)c1c(C(=O)NCc2ccc(F)c(F)c2)c2ccc(-c3ccncc3)cc2n1Cc1ccccc1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3655506 OBDepict Br S N O N N H O N O CH 3 H 3 C F F IC50 = 23.0 nM 587.45 CC(C)c1c(C(=O)NCc2ccc(F)c(F)c2)c2ccc(Oc3ncc(Br)s3)cc2n1Cc1ncco1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3739440 OBDepict H 3 C O N O HO IC50 = 23.0 nM 333.47 CCCCCCCCCOc1ccc(CN2CC(C(=O)O)C2)cc1 Homo sapiens CHEMBL3744620 cell-based format
CHEMBL3655416 OBDepict CH 3 N H 3 C O O N N H O CH 3 H 3 C F F IC50 = 24.0 nM 505.57 CC(C)c1c(C(=O)NCc2ccc(F)c(F)c2)c2ccc(OC(=O)N(C)C)cc2n1Cc1ccccc1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3655511 OBDepict H 3 C O O N CH 3 CH 3 N H O O F F IC50 = 24.0 nM 498.57 CCOC(=O)Cn1c(C(C)C)c(C(=O)NCc2ccc(F)c(F)c2)c2ccc(OC3CCCC3)cc21 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3655427 OBDepict CH 3 O O N N H O N CH 3 H 3 C F F IC50 = 24.0 nM 491.54 CCOC(=O)c1ccc2c(C(=O)NCc3cc(F)cc(F)c3)c(C(C)C)n(Cc3ccccn3)c2c1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3655424 OBDepict CH 3 O O N N H O H 3 C CH 3 N F IC50 = 24.0 nM 473.55 CCOC(=O)c1ccc2c(C(=O)NCc3cncc(F)c3)c(C(C)C)n(Cc3ccccc3)c2c1 Homo sapiens CHEMBL3705332 single protein format
CHEMBL3655442 OBDepict F F HN O N CH 3 H 3 C N O N H CH 3 IC50 = 25.0 nM 502.57 CC(C)c1c(C(=O)NCc2ccc(F)c(F)c2)c2ccc(C3=N[C@@H](C)CO3)cc2n1Cc1ccccn1 Homo sapiens CHEMBL3705332 single protein format