HOME LIGAND hPROTEOME OTHERS DOCUMENT

Q9H228 | S1PR5_HUMAN | Sphingosine 1-phosphate receptor 5 (S1PR5)

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
CHEMBL4787458 OBDepict OH O N O H 3 C Ki = 0.3 nM 435.61 Cc1cc(OC2CCC3(CCCC3)CC2)c(CN2CCC(C(=O)O)CC2)c2ccccc12 Homo sapiens CHEMBL4725117 cell membrane format
CHEMBL381872 OBDepict OH O N N N O F F F IC50 = 0.3 nM 431.41 O=C(O)C1CN(Cc2ccc(-c3noc(-c4ccc(CCC(F)(F)F)cc4)n3)cc2)C1 Homo sapiens CHEMBL880433 cell-based format
CHEMBL195014 OBDepict OH O N N N O H F F IC50 = 0.4 nM 439.46 O=C(O)C1CN(Cc2ccc(-c3noc(-c4ccc([C@@H]5CCC(F)(F)C5)cc4)n3)cc2)C1 Homo sapiens CHEMBL880433 cell-based format
CHEMBL198976 OBDepict OH O N N N O IC50 = 0.5 nM 403.48 O=C(O)C1CN(Cc2ccc(-c3noc(-c4ccc(C5CCCC5)cc4)n3)cc2)C1 Homo sapiens CHEMBL880433 cell-based format
CHEMBL198415 OBDepict OH O N N N O H F F IC50 = 0.5 nM 439.46 O=C(O)C1CN(Cc2ccc(-c3noc(-c4ccc([C@H]5CCC(F)(F)C5)cc4)n3)cc2)C1 Homo sapiens CHEMBL880433 cell-based format
CHEMBL225155 OBDepict H 3 C OH H NH 2 H O P O OH OH IC50 = 0.55 nM 379.48 CCCCCCCCCCCCC/C=C/[C@@H](O)[C@@H](N)COP(=O)(O)O Homo sapiens CHEMBL913923 cell-based format
CHEMBL4093489 OBDepict CH 3 O H 3 C O CH 3 N O HO Ki = 0.574 nM 435.56 CCCc1ccc(COc2ccc3c(c2)CCC(CN2CC(C(=O)O)C2)=C3C)c(OC)c1 Homo sapiens CHEMBL4032320 cell-based format
CHEMBL184879 OBDepict CH 3 N H P O OH OH IC50 = 0.73 nM 381.5 CCCCCCCCCc1ccc(C2CCC(CCP(=O)(O)O)N2)cc1 Homo sapiens CHEMBL833013 cell-based format
CHEMBL114606 OBDepict H 3 C NH 2 O OH P O OH HO IC50 = 0.77 nM 387.46 CCCCCCCCc1ccc(CCC(N)(CO)COP(=O)(O)O)cc1 Homo sapiens CHEMBL913923 cell-based format
CHEMBL1161691 OBDepict CH 3 NH 2 O OH P HO HO OH H IC50 = 0.77 nM 389.47 CCCCCCCCc1ccc(CCC(N)(CO)CO[PH](O)(O)O)cc1 Homo sapiens CHEMBL833013 cell-based format
CHEMBL196534 OBDepict OH O N N N O IC50 = 0.8 nM 417.51 O=C(O)C1CN(Cc2ccc(-c3noc(-c4ccc(C5CCCCC5)cc4)n3)cc2)C1 Homo sapiens CHEMBL880433 cell-based format
CHEMBL193789 OBDepict CH 3 O N N N O HO IC50 = 1.0 nM 391.47 CCCCc1ccc(-c2nc(-c3ccc(CN4CC(C(=O)O)C4)cc3)no2)cc1 Homo sapiens CHEMBL880433 cell-based format
CHEMBL1973936 OBDepict OH O N F F F IC50 = 1.0 nM 363.38 O=C(O)C1CN(Cc2ccc(CCc3cccc(C(F)(F)F)c3)cc2)C1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL3741414 OBDepict CH 3 O H H 2 N O P O OH HO IC50 < 1.0 nM 399.47 CCCCCCCCOc1ccc([C@@H]2CC[C@](N)(COP(=O)(O)O)C2)cc1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL1990223 OBDepict OH O N H 3 C O Cl Cl IC50 = 1.0 nM 380.27 Cc1cc(OCc2ccc(Cl)c(Cl)c2)ccc1CN1CC(C(=O)O)C1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL1966501 OBDepict OH O N H 3 C O F F F IC50 = 1.0 nM 379.38 Cc1cc(OCc2cccc(C(F)(F)F)c2)ccc1CN1CC(C(=O)O)C1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL3741092 OBDepict OH O N Cl O F F F IC50 = 1.0 nM 399.8 O=C(O)C1CN(Cc2ccc(OCc3cccc(C(F)(F)F)c3)c(Cl)c2)C1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL3739440 OBDepict H 3 C O N O HO IC50 = 1.0 nM 333.47 CCCCCCCCCOc1ccc(CN2CC(C(=O)O)C2)cc1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL194419 OBDepict CH 3 H 3 C O N N N O HO IC50 = 1.0 nM 391.47 CC(C)Cc1ccc(-c2nc(-c3ccc(CN4CC(C(=O)O)C4)cc3)no2)cc1 Homo sapiens CHEMBL880433 cell-based format
CHEMBL473269 OBDepict CH 3 O F N N H H 2 N H 3 C O P O OH HO IC50 = 1.1 nM 443.46 CCCCCCCCOc1ccc(-c2c[nH]c([C@@](C)(N)COP(=O)(O)O)n2)cc1F Homo sapiens CHEMBL1029038 single protein format
CHEMBL181597 OBDepict H 3 C N H H H P O OH OH IC50 = 1.2 nM 395.52 CCCCCCCCCc1ccc(CN[C@H]2CCC[C@H](P(=O)(O)O)C2)cc1 Homo sapiens CHEMBL833013 cell-based format
CHEMBL474689 OBDepict CH 3 O N N H H 2 N H 3 C O P O OH HO IC50 = 1.4 nM 425.47 CCCCCCCCOc1ccc(-c2c[nH]c([C@@](C)(N)COP(=O)(O)O)n2)cc1 Homo sapiens CHEMBL1029038 single protein format
CHEMBL4798593 OBDepict OH O HN O CH 3 H H CH 3 CH 3 H 3 C Ki = 1.4 nM 397.56 Cc1cc(O[C@H]2CC[C@H](C(C)(C)C)CC2)c(CNCCC(=O)O)c2ccccc12 Homo sapiens CHEMBL4725117 cell membrane format
CHEMBL194578 OBDepict CH 3 O N N N O HO IC50 = 1.6 nM 377.44 CCCc1ccc(-c2nc(-c3ccc(CN4CC(C(=O)O)C4)cc3)no2)cc1 Homo sapiens CHEMBL880433 cell-based format
CHEMBL372066 OBDepict CH 3 H 3 C H 3 C O N N N O HO IC50 = 1.8 nM 405.5 CCC(C)(C)c1ccc(-c2nc(-c3ccc(CN4CC(C(=O)O)C4)cc3)no2)cc1 Homo sapiens CHEMBL880433 cell-based format
CHEMBL3741572 OBDepict OH O N F O F F F IC50 = 2.0 nM 383.34 O=C(O)C1CN(Cc2ccc(OCc3cccc(C(F)(F)F)c3)c(F)c2)C1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL1986265 OBDepict OH O N Cl O F F F IC50 = 2.0 nM 399.8 O=C(O)C1CN(Cc2ccc(OCc3cccc(C(F)(F)F)c3)cc2Cl)C1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL1998478 OBDepict OH O N F O F F F IC50 = 2.0 nM 383.34 O=C(O)C1CN(Cc2ccc(OCc3cccc(C(F)(F)F)c3)cc2F)C1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL184349 OBDepict CH 3 N P O OH HO IC50 = 2.2 nM 367.47 CCCCCCCCCc1ccc(CN2CCC(P(=O)(O)O)C2)cc1 Homo sapiens CHEMBL833013 cell-based format
CHEMBL473156 OBDepict O N H NH 2 H 3 C O P O OH OH O IC50 = 2.9 nM 436.45 C[C@](N)(COP(=O)(O)O)C(=O)Nc1ccc(OCCCCCc2ccccc2)cc1 Homo sapiens CHEMBL980651 single protein format
CHEMBL3740090 OBDepict H 3 C CH 3 O N O HO IC50 = 3.0 nM 277.36 CC(C)CCOc1ccc(CN2CC(C(=O)O)C2)cc1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL3740359 OBDepict H 3 C N O HO IC50 = 3.0 nM 295.38 CCc1ccc(-c2ccc(CN3CC(C(=O)O)C3)cc2)cc1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL474688 OBDepict H 3 C O F N H O H 2 N CH 3 O P O OH OH IC50 = 3.2 nM 420.42 CCCCCCCCOc1ccc(NC(=O)[C@@](C)(N)COP(=O)(O)O)c(F)c1 Homo sapiens CHEMBL1029038 single protein format
CHEMBL470511 OBDepict CH 3 NH 2 N N O H P O OH HO O IC50 = 3.5 nM 459.48 C[C@](N)(COP(=O)(O)O)c1nc(-c2ccc(OCCCCCc3ccccc3)cc2)c[nH]1 Homo sapiens CHEMBL980651 single protein format
CHEMBL1971132 OBDepict OH O N O F F F IC50 = 4.0 nM 365.35 O=C(O)C1CN(Cc2ccc(OCc3cccc(C(F)(F)F)c3)cc2)C1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL1968499 OBDepict OH O N O Cl Cl IC50 = 4.0 nM 366.24 O=C(O)C1CN(Cc2ccc(OCc3ccc(Cl)cc3Cl)cc2)C1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL194898 OBDepict OH O N N N O IC50 = 4.0 nM 389.46 O=C(O)C1CN(Cc2ccc(-c3noc(-c4ccc(C5CCC5)cc4)n3)cc2)C1 Homo sapiens CHEMBL880433 cell-based format
CHEMBL4748198 OBDepict HO O N O CH 3 H H H 3 C H 3 C CH 3 Ki = 4.4 nM 437.62 Cc1cc(O[C@H]2CC[C@H](C(C)(C)C)CC2)c(CN2CCC(C(=O)O)CC2)c2ccccc12 Homo sapiens CHEMBL4725117 cell membrane format
CHEMBL3740093 OBDepict OH O N F O Cl Cl IC50 = 5.0 nM 384.23 O=C(O)C1CN(Cc2ccc(OCc3ccc(Cl)c(Cl)c3)c(F)c2)C1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL3741298 OBDepict OH O N F O Cl Cl IC50 = 5.0 nM 384.23 O=C(O)C1CN(Cc2ccc(OCc3ccc(Cl)c(Cl)c3)cc2F)C1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL3739878 OBDepict H 3 C O N O HO IC50 = 5.0 nM 319.45 CCCCCCCCOc1ccc(CN2CC(C(=O)O)C2)cc1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL3741022 OBDepict OH O N + N O O _ O Cl Cl IC50 = 5.0 nM 411.24 O=C(O)C1CN(Cc2ccc(OCc3ccc(Cl)c(Cl)c3)c([N+](=O)[O-])c2)C1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL195141 OBDepict OH O N N N O CH 3 H 3 C CH 3 IC50 = 5.2 nM 391.47 CC(C)(C)c1ccc(-c2nc(-c3ccc(CN4CC(C(=O)O)C4)cc3)no2)cc1 Homo sapiens CHEMBL880433 cell-based format
CHEMBL3741589 OBDepict OH O N O Cl Cl IC50 = 6.0 nM 366.24 O=C(O)C1CN(Cc2ccc(OCc3ccc(Cl)c(Cl)c3)cc2)C1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL1987998 OBDepict OH O N Cl O IC50 = 6.0 nM 331.8 O=C(O)C1CN(Cc2ccc(OCc3ccccc3)cc2Cl)C1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL371670 OBDepict CH 3 O N N N O HO IC50 = 6.4 nM 419.53 CCCCCCc1ccc(-c2nc(-c3ccc(CN4CC(C(=O)O)C4)cc3)no2)cc1 Homo sapiens CHEMBL880433 cell-based format
CHEMBL366181 OBDepict OH O N N N O CH 3 CH 3 CH 3 IC50 = 6.6 nM 405.5 CC(C)(C)Cc1ccc(-c2nc(-c3ccc(CN4CC(C(=O)O)C4)cc3)no2)cc1 Homo sapiens CHEMBL880433 cell-based format
CHEMBL515921 OBDepict CH 3 O F N H O NH 2 CH 3 O P O HO OH IC50 = 6.9 nM 420.42 CCCCCCCCOc1ccc(NC(=O)[C@@](C)(N)COP(=O)(O)O)cc1F Homo sapiens CHEMBL1029038 single protein format
CHEMBL3742384 OBDepict OH O N CH 3 IC50 = 7.0 nM 281.36 Cc1ccc(-c2ccc(CN3CC(C(=O)O)C3)cc2)cc1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL3742033 OBDepict OH O N H 3 C O IC50 = 8.0 nM 311.38 Cc1cc(OCc2ccccc2)ccc1CN1CC(C(=O)O)C1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL118860 OBDepict H 3 C N H P O OH OH IC50 = 8.2 nM 355.46 CCCCCCCCCc1ccc(CNCCCP(=O)(O)O)cc1 Homo sapiens CHEMBL833013 cell-based format
CHEMBL475495 OBDepict CH 3 O N H O NH 2 CH 3 O P O HO OH IC50 = 8.8 nM 402.43 CCCCCCCCOc1ccc(NC(=O)[C@@](C)(N)COP(=O)(O)O)cc1 Homo sapiens CHEMBL1029038 single protein format
CHEMBL3741496 OBDepict H 3 C O N O HO IC50 = 9.0 nM 305.42 CCCCCCCOc1ccc(CN2CC(C(=O)O)C2)cc1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL3741364 OBDepict CH 3 O O N Cl O HO Cl IC50 = 9.0 nM 396.27 COc1cc(CN2CC(C(=O)O)C2)ccc1OCc1ccc(Cl)cc1Cl Homo sapiens CHEMBL3744618 cell-based format
CHEMBL3739695 OBDepict OH O N O F IC50 = 9.0 nM 315.34 O=C(O)C1CN(Cc2ccc(OCc3ccc(F)cc3)cc2)C1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL3740060 OBDepict CH 3 O N O HO IC50 = 9.0 nM 291.39 CCCCCCOc1ccc(CN2CC(C(=O)O)C2)cc1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL1093823 OBDepict H N N H 2 N H 3 C O P O OH HO O F F F IC50 = 9.6 nM 547.47 C[C@](N)(COP(=O)(O)O)c1nc(-c2ccc(OCc3ccc(-c4ccccc4)cc3)c(C(F)(F)F)c2)c[nH]1 Homo sapiens CHEMBL1108115 cell-based format
CHEMBL514170 OBDepict H N N H 2 N H 3 C O P O OH HO O IC50 = 9.6 nM 479.47 C[C@](N)(COP(=O)(O)O)c1nc(-c2ccc(OCc3ccc(-c4ccccc4)cc3)cc2)c[nH]1 Homo sapiens CHEMBL980651 single protein format
CHEMBL375488 OBDepict CH 3 O N S O HO F F F IC50 = 10.0 nM 475.53 CCc1cc(CN2CC(C(=O)O)C2)ccc1OCc1cc(-c2ccccc2)c(C(F)(F)F)s1 Homo sapiens CHEMBL913923 cell-based format
CHEMBL3742245 OBDepict Cl O N O HO IC50 = 10.0 nM 331.8 O=C(O)C1CN(Cc2ccc(OCc3cccc(Cl)c3)cc2)C1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL117723 OBDepict H 3 C O Br O CH 3 N H P O OH OH IC50 = 10.0 nM 466.35 CCCCCCCCOc1c(Br)cc(CNCCCP(=O)(O)O)cc1OC Homo sapiens CHEMBL913923 cell-based format
CHEMBL3742304 OBDepict CH 3 O N O HO IC50 = 10.0 nM 277.36 CCCCCOc1ccc(CN2CC(C(=O)O)C2)cc1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL224623 OBDepict H 3 C N O HO IC50 = 11.0 nM 317.47 CCCCCCCCCc1ccc(CN2CC(C(=O)O)C2)cc1 Homo sapiens CHEMBL913923 cell-based format
CHEMBL208838 OBDepict HO O H N H H N N O H F F IC50 = 11.0 nM 453.49 O=C(O)C[C@@H]1CN[C@@H](c2ccc(-c3noc(-c4ccc([C@@H]5CCC(F)(F)C5)cc4)n3)cc2)C1 Homo sapiens CHEMBL864692 cell-based format
CHEMBL195025 OBDepict OH O N N N O IC50 = 11.0 nM 411.46 O=C(O)C1CN(Cc2ccc(-c3noc(-c4ccc(-c5ccccc5)cc4)n3)cc2)C1 Homo sapiens CHEMBL880433 cell-based format
CHEMBL224853 OBDepict OH O N CH 3 CH 3 O S F F F IC50 = 12.0 nM 475.53 Cc1cc(CN2CC(C(=O)O)C2)cc(C)c1OCc1cc(-c2ccccc2)c(C(F)(F)F)s1 Homo sapiens CHEMBL913923 cell-based format
CHEMBL196357 OBDepict CH 3 O H 3 C O N N N O HO IC50 = 12.0 nM 393.44 CC(C)Oc1ccc(-c2nc(-c3ccc(CN4CC(C(=O)O)C4)cc3)no2)cc1 Homo sapiens CHEMBL880433 cell-based format
CHEMBL371985 OBDepict HO O N N N O IC50 = 12.0 nM 375.43 O=C(O)C1CN(Cc2ccc(-c3noc(-c4ccc(C5CC5)cc4)n3)cc2)C1 Homo sapiens CHEMBL880433 cell-based format
CHEMBL515917 OBDepict CH 3 NH 2 N N O H P O OH HO O IC50 = 12.8 nM 445.46 C[C@](N)(COP(=O)(O)O)c1nc(-c2ccc(OCCCCc3ccccc3)cc2)c[nH]1 Homo sapiens CHEMBL980651 single protein format
CHEMBL334213 OBDepict H 3 C N H P O OH OH IC50 = 13.0 nM 335.47 CCCCCCCCCCCCCCNCCCP(=O)(O)O Homo sapiens CHEMBL833013 cell-based format
CHEMBL224005 OBDepict OH O N CH 3 O S F F F IC50 = 13.0 nM 461.51 Cc1cc(CN2CC(C(=O)O)C2)ccc1OCc1cc(-c2ccccc2)c(C(F)(F)F)s1 Homo sapiens CHEMBL913923 cell-based format
CHEMBL209076 OBDepict HO O H N H H N N O H F F IC50 = 13.0 nM 453.49 O=C(O)C[C@@H]1CC[C@H](c2ccc(-c3noc(-c4ccc([C@@H]5CCC(F)(F)C5)cc4)n3)cc2)N1 Homo sapiens CHEMBL871183 cell-based format
CHEMBL187692 OBDepict CH 3 N H P O HO CH 3 IC50 = 15.0 nM 373.56 CCCCCCCCCCCCCC1CCCC(CCP(C)(=O)O)N1 Homo sapiens CHEMBL833013 cell-based format
CHEMBL3739759 OBDepict CH 3 O N O HO IC50 = 16.0 nM 319.44 CCCCCCOc1ccc(CN2CCC(C(=O)O)CC2)cc1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL210257 OBDepict HO O H N H H N N O H F F IC50 = 16.0 nM 453.49 O=C(O)C[C@@H]1CC[C@H](c2ccc(-c3noc(-c4ccc([C@H]5CCC(F)(F)C5)cc4)n3)cc2)N1 Homo sapiens CHEMBL871183 cell-based format
CHEMBL3741743 OBDepict OH O N IC50 = 16.0 nM 295.38 O=C(O)C1CN(Cc2ccc(CCc3ccccc3)cc2)C1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL225575 OBDepict OH O N N N O S F F F IC50 = 16.0 nM 485.49 O=C(O)C1CN(Cc2ccc(-c3noc(-c4cc(-c5ccccc5)c(C(F)(F)F)s4)n3)cc2)C1 Homo sapiens CHEMBL913923 cell-based format
CHEMBL187588 OBDepict H 3 C H HN H P O HO OH IC50 = 17.0 nM 375.53 CCCCCCCCCCCCCC[C@H]1CC[C@H](CCP(=O)(O)O)N1 Homo sapiens CHEMBL833013 cell-based format
CHEMBL224571 OBDepict OH O N Cl O S F F F IC50 = 18.0 nM 481.92 O=C(O)C1CN(Cc2ccc(OCc3cc(-c4ccccc4)c(C(F)(F)F)s3)c(Cl)c2)C1 Homo sapiens CHEMBL913923 cell-based format
CHEMBL364899 OBDepict OH O N O N N CH 3 CH 3 CH 3 IC50 = 20.0 nM 391.47 CC(C)(C)c1ccc(-c2noc(-c3ccc(CN4CC(C(=O)O)C4)cc3)n2)cc1 Homo sapiens CHEMBL880433 cell-based format
CHEMBL210520 OBDepict HO O H N H H N N O IC50 = 20.0 nM 431.54 O=C(O)C[C@@H]1CC[C@H](c2ccc(-c3noc(-c4ccc(C5CCCCC5)cc4)n3)cc2)N1 Homo sapiens CHEMBL871183 cell-based format
CHEMBL208648 OBDepict HO O H N H H N N O F F IC50 = 21.0 nM 467.52 O=C(O)C[C@@H]1CN[C@@H](c2ccc(-c3noc(-c4ccc(C5CCC(F)(F)CC5)cc4)n3)cc2)C1 Homo sapiens CHEMBL864692 cell-based format
CHEMBL224549 OBDepict OH O N O F F F S F F F IC50 = 21.0 nM 515.48 O=C(O)C1CN(Cc2ccc(OCc3cc(-c4ccccc4)c(C(F)(F)F)s3)c(C(F)(F)F)c2)C1 Homo sapiens CHEMBL913923 cell-based format
CHEMBL425563 OBDepict OH O N O S F F F IC50 = 23.0 nM 447.48 O=C(O)C1CN(Cc2ccc(OCc3cc(-c4ccccc4)c(C(F)(F)F)s3)cc2)C1 Homo sapiens CHEMBL864692 cell-based format
CHEMBL3742345 OBDepict OH O N Cl Cl IC50 = 23.0 nM 336.22 O=C(O)C1CN(Cc2ccc(-c3ccc(Cl)c(Cl)c3)cc2)C1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL185100 OBDepict H 3 C N CH 3 P O OH OH IC50 = 24.0 nM 349.5 CCCCCCCCCCCCCCN(C)CCCP(=O)(O)O Homo sapiens CHEMBL833013 cell-based format
CHEMBL3739509 OBDepict CH 3 O N H O HO IC50 = 26.0 nM 305.42 CCCCCCOc1ccc(CN2CC[C@@H](C(=O)O)C2)cc1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL473562 OBDepict O N H NH 2 H 3 C O P O OH OH O IC50 = 26.2 nM 428.47 C[C@](N)(COP(=O)(O)O)C(=O)Nc1ccc(OCCCCC2CCCCC2)cc1 Homo sapiens CHEMBL980651 single protein format
CHEMBL3739964 OBDepict CH 3 O N CH 3 O HO IC50 = 28.0 nM 333.47 CCCCCCOc1ccc(CN2CCC(C(=O)O)C(C)C2)cc1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL224703 OBDepict CH 3 N O HO IC50 = 29.0 nM 331.5 CCCCCCCCCc1ccc(CN2CCC(C(=O)O)C2)cc1 Homo sapiens CHEMBL913923 cell-based format
CHEMBL377637 OBDepict CH 3 CH 3 O N N H NH H O HO IC50 = 30.0 nM 419.53 CC(C)Cc1ccc(-c2nc(-c3ccc([C@H]4CC[C@@H](CCC(=O)O)N4)cc3)no2)cc1 Homo sapiens CHEMBL871183 cell-based format
CHEMBL426688 OBDepict HO O H N H H N N O F IC50 = 30.0 nM 435.5 O=C(O)C[C@@H]1CC[C@H](c2ccc(-c3noc(-c4ccc(C5CCCC5)c(F)c4)n3)cc2)N1 Homo sapiens CHEMBL871183 cell-based format
CHEMBL426191 OBDepict OH O N Cl Cl O S F F F IC50 = 33.0 nM 516.37 O=C(O)C1CN(Cc2cc(Cl)c(OCc3cc(-c4ccccc4)c(C(F)(F)F)s3)c(Cl)c2)C1 Homo sapiens CHEMBL913923 cell-based format
CHEMBL184237 OBDepict H 3 C N OH P O OH OH IC50 = 34.0 nM 363.48 CCCCCCCCCCCCCCN1CCC(O)(P(=O)(O)O)C1 Homo sapiens CHEMBL833013 cell-based format
CHEMBL3740768 OBDepict OH O N O CH 3 IC50 = 35.0 nM 311.38 Cc1ccccc1COc1ccc(CN2CC(C(=O)O)C2)cc1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL363008 OBDepict CH 3 N P HO O OH HO IC50 = 40.0 nM 377.51 CCCCCCCCCCCCCCN1CCC(C(O)P(=O)(O)O)C1 Homo sapiens CHEMBL833013 cell-based format
CHEMBL389880 OBDepict OH O N F O S F F F IC50 = 41.0 nM 465.47 O=C(O)C1CN(Cc2ccc(OCc3cc(-c4ccccc4)c(C(F)(F)F)s3)c(F)c2)C1 Homo sapiens CHEMBL913923 cell-based format
CHEMBL3741775 OBDepict OH O N F O IC50 = 41.0 nM 315.34 O=C(O)C1CN(Cc2ccc(OCc3ccccc3)c(F)c2)C1 Homo sapiens CHEMBL3744618 cell-based format
CHEMBL514302 OBDepict O N H NH 2 H 3 C O P O OH OH O IC50 = 43.6 nM 422.42 C[C@](N)(COP(=O)(O)O)C(=O)Nc1ccc(OCCCCc2ccccc2)cc1 Homo sapiens CHEMBL980651 single protein format
CHEMBL371743 OBDepict CH 3 O O N N N O HO IC50 = 48.0 nM 379.42 CCOc1ccc(-c2nc(-c3ccc(CN4CC(C(=O)O)C4)cc3)no2)cc1 Homo sapiens CHEMBL880433 cell-based format