HOME LIGAND hPROTEOME OTHERS DOCUMENT

Q92753 | RORB_HUMAN | Nuclear receptor ROR-beta (RORB)

3D structures mapped by conservation among orthologs



[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL38 OBDepict CH 3 CH 3 CH 3 H 3 C CH 3 O OH IC50 = 0.15 nM 300.44 CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C(=O)O)C(C)(C)CCC1 Homo sapiens CHEMBL3227241 single protein format
CHEMBL4289691 OBDepict Cl Cl S H 2 N O Cl IC50 < 10.0 nM 382.7 Nc1cc(-c2cc(Cl)cc(Cl)c2)c(C(=O)c2ccccc2Cl)s1 Homo sapiens CHEMBL4266821 assay format
CHEMBL4292343 OBDepict CH 3 O CH 3 Br S O Cl IC50 = 15.0 nM 435.77 CC(C)Oc1cc(Br)cc(-c2ccsc2C(=O)c2ccccc2Cl)c1 Homo sapiens CHEMBL4266821 assay format
CHEMBL4289114 OBDepict Br N F F F S O Cl IC50 = 26.0 nM 446.68 O=C(c1ccccc1Cl)c1scnc1-c1cc(Br)cc(C(F)(F)F)c1 Homo sapiens CHEMBL4266821 assay format
CHEMBL4284016 OBDepict Cl O S N F F F IC50 = 34.0 nM 367.78 O=C(c1ccccc1Cl)c1scnc1-c1cccc(C(F)(F)F)c1 Homo sapiens CHEMBL4266821 assay format
CHEMBL4276720 OBDepict NH 2 S O Cl F F F IC50 = 40.0 nM 381.81 Nc1cc(-c2cccc(C(F)(F)F)c2)c(C(=O)c2ccccc2Cl)s1 Homo sapiens CHEMBL4266821 assay format
CHEMBL4225808 OBDepict CH 3 S O O N H O S N O Cl Cl IC50 = 59.0 nM 559.5 CCS(=O)(=O)c1ccc(CC(=O)Nc2nc(-c3ccccc3Cl)c(C(=O)c3ccccc3Cl)s2)cc1 Homo sapiens CHEMBL4222296 assay format
CHEMBL4226645 OBDepict H 2 N N S O Br Cl F F F IC50 = 63.0 nM 461.69 Nc1nc(-c2cc(Br)cc(C(F)(F)F)c2)c(C(=O)c2ccccc2Cl)s1 Homo sapiens CHEMBL4222296 assay format
CHEMBL3105681 OBDepict CH 3 S O O N H O N S O Cl Cl IC50 = 64.0 nM 559.5 CCS(=O)(=O)c1ccc(CC(=O)Nc2nc(-c3cccc(Cl)c3)c(C(=O)c3ccccc3Cl)s2)cc1 Homo sapiens CHEMBL3385307 assay format
CHEMBL4291888 OBDepict CH 3 O O S H 2 N F F F IC50 = 76.0 nM 377.39 COc1ccccc1C(=O)c1sc(N)cc1-c1cccc(C(F)(F)F)c1 Homo sapiens CHEMBL4266821 assay format
CHEMBL4128042 OBDepict O N H S N H H O HO N H O H 3 C CH 3 H F F F IC50 = 83.0 nM 591.7 C[C@H](NC(=O)c1cc(-c2sc(C(=O)N[C@H]3C[C@H](C(=O)O)C3)nc2CC2CCCCC2)cc(C2(C)CC2)c1)C(F)(F)F Homo sapiens CHEMBL4121351 cell-based format
CHEMBL4284644 OBDepict Cl N S O Cl IC50 = 87.0 nM 334.23 O=C(c1ccccc1Cl)c1sccc1-c1ccnc(Cl)c1 Homo sapiens CHEMBL4266821 assay format
CHEMBL4286904 OBDepict Cl O S IC50 = 90.0 nM 348.85 O=C(c1ccccc1Cl)c1sccc1-c1cccc2ccccc12 Homo sapiens CHEMBL4266821 assay format
CHEMBL4293341 OBDepict NH 2 O Cl F F F IC50 = 90.0 nM 375.78 Nc1ccc(C(=O)c2ccccc2Cl)c(-c2cccc(C(F)(F)F)c2)c1 Homo sapiens CHEMBL4266821 assay format
CHEMBL4225823 OBDepict H 2 N N S O F F F F F F IC50 = 90.0 nM 416.35 Nc1nc(-c2cccc(C(F)(F)F)c2)c(C(=O)c2ccccc2C(F)(F)F)s1 Homo sapiens CHEMBL4222296 assay format
CHEMBL4288028 OBDepict CH 3 O O S N F F F IC50 = 94.0 nM 363.36 COc1ccccc1C(=O)c1scnc1-c1cccc(C(F)(F)F)c1 Homo sapiens CHEMBL4266821 assay format
CHEMBL4226392 OBDepict NH 2 S N O Br F F F IC50 = 110.0 nM 427.25 Nc1nc(-c2cccc(C(F)(F)F)c2)c(C(=O)c2ccccc2Br)s1 Homo sapiens CHEMBL4222296 assay format
CHEMBL4126534 OBDepict O N H S N H H O HO N H O H 3 C CH 3 CH 3 CH 3 IC50 = 115.0 nM 551.75 CC(C)(C)NC(=O)c1cc(-c2sc(C(=O)N[C@H]3C[C@H](C(=O)O)C3)nc2CC2CCCCC2)cc(C2(C)CC2)c1 Homo sapiens CHEMBL4121351 cell-based format
CHEMBL4127926 OBDepict O N H S N H H O OH N H O CH 3 CH 3 CH 3 CH 3 H F F F IC50 = 119.0 nM 593.71 C[C@H](NC(=O)c1cc(-c2sc(C(=O)N[C@H]3C[C@H](C(=O)O)C3)nc2CC2CCCCC2)cc(C(C)(C)C)c1)C(F)(F)F Homo sapiens CHEMBL4121351 cell-based format
CHEMBL4227190 OBDepict H 2 N S N O Cl Cl F F F IC50 = 120.0 nM 417.24 Nc1nc(-c2ccc(Cl)c(C(F)(F)F)c2)c(C(=O)c2ccccc2Cl)s1 Homo sapiens CHEMBL4222296 assay format
CHEMBL4228640 OBDepict NH 2 N S O F F F F F F F IC50 = 130.0 nM 434.34 Nc1nc(-c2cccc(C(F)(F)F)c2)c(C(=O)c2c(F)cccc2C(F)(F)F)s1 Homo sapiens CHEMBL4222296 assay format
CHEMBL4281271 OBDepict CH 3 O O S H 2 N Cl IC50 = 130.0 nM 343.84 COc1ccccc1C(=O)c1sc(N)cc1-c1cccc(Cl)c1 Homo sapiens CHEMBL4266821 assay format
CHEMBL4227927 OBDepict H 2 N N S O Cl Cl F F F IC50 = 140.0 nM 417.24 Nc1nc(-c2cc(Cl)cc(C(F)(F)F)c2)c(C(=O)c2ccccc2Cl)s1 Homo sapiens CHEMBL4222296 assay format
CHEMBL4126366 OBDepict O NH N S H H O HO S HN O O CH 3 CH 3 CH 3 IC50 = 154.0 nM 587.81 CC(C)(C)NS(=O)(=O)c1ccc(-c2sc(C(=O)N[C@H]3C[C@H](C(=O)O)C3)nc2CC2CCCCC2)c2c1CCCC2 Homo sapiens CHEMBL4121351 cell-based format
CHEMBL4225264 OBDepict H 3 C O O S N NH 2 Cl F F F IC50 = 160.0 nM 412.82 COc1ccccc1C(=O)c1sc(N)nc1-c1ccc(Cl)c(C(F)(F)F)c1 Homo sapiens CHEMBL4222296 assay format
CHEMBL4227867 OBDepict CH 3 O O S N H 2 N Br F F F IC50 = 160.0 nM 457.27 COc1ccccc1C(=O)c1sc(N)nc1-c1cc(Br)cc(C(F)(F)F)c1 Homo sapiens CHEMBL4222296 assay format
CHEMBL4128262 OBDepict N NH S O O S N NH O OH CH 3 H 3 C IC50 = 163.0 nM 566.75 CC(C)(O)CNC(=O)c1nc(CC2CCCCC2)c(-c2ccc(S(=O)(=O)NC3(C#N)CC3)c3ccccc23)s1 Homo sapiens CHEMBL4121351 cell-based format
CHEMBL4128926 OBDepict OH O H H N H O N S S HN O O CH 3 CH 3 CH 3 IC50 = 164.0 nM 583.78 CC(C)(C)NS(=O)(=O)c1ccc(-c2sc(C(=O)N[C@H]3C[C@H](C(=O)O)C3)nc2CC2CCCCC2)c2ccccc12 Homo sapiens CHEMBL4121351 cell-based format
CHEMBL4284441 OBDepict H 3 C O O S Cl IC50 = 180.0 nM 328.82 COc1ccccc1C(=O)c1sccc1-c1cccc(Cl)c1 Homo sapiens CHEMBL4266821 assay format
CHEMBL4290788 OBDepict Cl O F F F IC50 = 180.0 nM 360.76 O=C(c1ccccc1Cl)c1ccccc1-c1cccc(C(F)(F)F)c1 Homo sapiens CHEMBL4266821 assay format
CHEMBL4276733 OBDepict CH 3 O O S H 2 N Cl Cl IC50 = 200.0 nM 378.28 COc1ccccc1C(=O)c1sc(N)cc1-c1cc(Cl)cc(Cl)c1 Homo sapiens CHEMBL4266821 assay format
CHEMBL4288937 OBDepict CH 3 O O S F F F IC50 = 220.0 nM 362.37 COc1ccccc1C(=O)c1sccc1-c1cccc(C(F)(F)F)c1 Homo sapiens CHEMBL4266821 assay format
CHEMBL4281036 OBDepict H 3 C O O S N Cl IC50 = 230.0 nM 329.81 COc1ccccc1C(=O)c1sccc1-c1ccnc(Cl)c1 Homo sapiens CHEMBL4266821 assay format
CHEMBL4285419 OBDepict Cl O S F F F IC50 = 230.0 nM 366.79 O=C(c1ccccc1Cl)c1sccc1-c1cccc(C(F)(F)F)c1 Homo sapiens CHEMBL4266821 assay format
CHEMBL4226071 OBDepict H 2 N N S O Cl Cl IC50 = 240.0 nM 349.24 Nc1nc(-c2cccc(Cl)c2)c(C(=O)c2ccccc2Cl)s1 Homo sapiens CHEMBL4222296 assay format
CHEMBL4292696 OBDepict H 2 N S O Cl F F F F F F IC50 = 240.0 nM 449.8 Nc1cc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(C(=O)c2ccccc2Cl)s1 Homo sapiens CHEMBL4266821 assay format
CHEMBL4225424 OBDepict CH 3 O O S N H 2 N F F F F F F IC50 = 290.0 nM 446.37 COc1ccccc1C(=O)c1sc(N)nc1-c1cc(C(F)(F)F)cc(C(F)(F)F)c1 Homo sapiens CHEMBL4222296 assay format
CHEMBL4226334 OBDepict H 2 N S N O Cl Br F F F IC50 = 290.0 nM 461.69 Nc1nc(-c2ccc(Br)c(C(F)(F)F)c2)c(C(=O)c2ccccc2Cl)s1 Homo sapiens CHEMBL4222296 assay format
CHEMBL4227134 OBDepict H 2 N S N O Cl F F F F F F IC50 = 310.0 nM 450.79 Nc1nc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(C(=O)c2ccccc2Cl)s1 Homo sapiens CHEMBL4222296 assay format
CHEMBL3314002 OBDepict CH 3 HN CH 3 CH 3 S O O CH 3 Cl S N HN O H H O HO IC50 = 326.0 nM 596.22 CCC(C)(C)NS(=O)(=O)c1ccc(-c2sc(C(=O)N[C@H]3C[C@H](C(=O)O)C3)nc2CC2CCCCC2)c(Cl)c1C Homo sapiens CHEMBL4121351 cell-based format
CHEMBL4284673 OBDepict CH 3 O O S H 2 N N Cl IC50 = 330.0 nM 344.82 COc1ccccc1C(=O)c1sc(N)cc1-c1ccnc(Cl)c1 Homo sapiens CHEMBL4266821 assay format
CHEMBL4277389 OBDepict Cl O S IC50 = 360.0 nM 374.89 O=C(c1ccccc1Cl)c1sccc1-c1cccc(-c2ccccc2)c1 Homo sapiens CHEMBL4266821 assay format
CHEMBL4228057 OBDepict CH 3 O O S N H 2 N F F F IC50 = 370.0 nM 378.38 COc1ccccc1C(=O)c1sc(N)nc1-c1cccc(C(F)(F)F)c1 Homo sapiens CHEMBL4222296 assay format
CHEMBL4285780 OBDepict Cl O S O O IC50 = 380.0 nM 342.8 O=C(c1ccccc1Cl)c1sccc1-c1ccc2c(c1)OCO2 Homo sapiens CHEMBL4266821 assay format
CHEMBL4227440 OBDepict H 2 N N S O Br Cl IC50 = 410.0 nM 393.69 Nc1nc(-c2cccc(Br)c2)c(C(=O)c2ccccc2Cl)s1 Homo sapiens CHEMBL4222296 assay format
CHEMBL4228577 OBDepict NH 2 N S O F Cl F F F IC50 = 410.0 nM 400.78 Nc1nc(-c2cccc(C(F)(F)F)c2)c(C(=O)c2c(F)cccc2Cl)s1 Homo sapiens CHEMBL4222296 assay format
CHEMBL4647899 OBDepict CH 3 HN H F F F S O O Cl Cl S N H 3 C H 3 C O HO IC50 = 436.0 nM 587.51 CC[C@H](NS(=O)(=O)c1ccc(-c2sc(CC(C)(C)C(=O)O)nc2CC2CCC2)c(Cl)c1Cl)C(F)(F)F Homo sapiens CHEMBL4623398 cell-based format
CHEMBL4293998 OBDepict Cl Cl S O Cl IC50 = 470.0 nM 367.68 O=C(c1ccccc1Cl)c1sccc1-c1ccc(Cl)c(Cl)c1 Homo sapiens CHEMBL4266821 assay format
CHEMBL4129634 OBDepict OH O H H N H O N S S HN O O CH 3 H F F F IC50 = 490.0 nM 595.67 C[C@H](NS(=O)(=O)c1ccc(-c2sc(C(=O)N[C@H]3C[C@H](C(=O)O)C3)nc2CC2CCC2)c2ccccc12)C(F)(F)F Homo sapiens CHEMBL4121351 cell-based format
CHEMBL4283486 OBDepict Cl S O Cl IC50 = 570.0 nM 333.24 O=C(c1ccccc1Cl)c1sccc1-c1cccc(Cl)c1 Homo sapiens CHEMBL4266821 assay format
CHEMBL4229273 OBDepict NH 2 S N O Cl F F F IC50 = 610.0 nM 382.79 Nc1nc(-c2cccc(C(F)(F)F)c2)c(C(=O)c2ccccc2Cl)s1 Homo sapiens CHEMBL4222296 assay format
CHEMBL4285720 OBDepict Cl N S O Cl Cl IC50 = 800.0 nM 368.67 O=C(c1ccc(Cl)c(Cl)c1)c1scnc1-c1cccc(Cl)c1 Homo sapiens CHEMBL4266821 assay format
CHEMBL4292527 OBDepict Cl O S CH 3 CH 3 CH 3 IC50 = 980.0 nM 354.9 CC(C)(C)c1ccc(-c2ccsc2C(=O)c2ccccc2Cl)cc1 Homo sapiens CHEMBL4266821 assay format