HOME LIGAND hPROTEOME OTHERS DOCUMENT

O75469 | NR1I2_HUMAN | Nuclear receptor subfamily 1 group I member 2 (NR1I2)

3D structures mapped by conservation among orthologs

[ Domain: "Nuclear receptor ligand-binding domain" // Hormone_recep_1 ]

download pymol session



[ 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
CHEMBL410683 OBDepict CH 3 O CH 3 H H H CH 3 O IC50 = 2.4 nM 312.45 C/C=C1C(=O)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C Homo sapiens CHEMBL880930 single protein format
CHEMBL402063 OBDepict CH 3 O CH 3 H H H CH 3 O IC50 = 2.4 nM 312.45 C/C=C1/C(=O)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C Homo sapiens CHEMBL880930 single protein format
CHEMBL501711 OBDepict H 3 C CH 3 H 3 C H O O O CH 3 CH 3 H 3 C H 3 C OH H 3 C H 3 C CH 3 H 3 C Ki = 27.0 nM 536.8 CC(C)=CCC[C@]1(C)[C@@H](CC=C(C)C)C[C@@]2(CC=C(C)C)C(=O)[C@]1(C(=O)C(C)C)C(=O)C(CC=C(C)C)=C2O Homo sapiens CHEMBL1012196 single protein format
CHEMBL62136 OBDepict F F F N S O O HO F F F F F F IC50 = 36.0 nM 481.34 O=S(=O)(c1ccccc1)N(CC(F)(F)F)c1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1 Homo sapiens CHEMBL4834539 single protein format
CHEMBL4877818 OBDepict N N N N S O O H 3 C CH 3 H 3 C O Cl CH 3 IC50 = 61.0 nM 430.92 COc1ccc(Cl)cc1-n1nnc(S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1C#N Homo sapiens CHEMBL4834539 single protein format
CHEMBL4850664 OBDepict CH 3 O N N O N NH 2 H 3 C S O O H 3 C CH 3 H 3 C IC50 = 180.0 nM 416.5 COc1ccc(OC)c(-n2nnc(S(=O)(=O)c3ccc(C(C)(C)C)cc3)c2N)c1 Homo sapiens CHEMBL4834539 single protein format
CHEMBL4863215 OBDepict CH 3 O N N O N CH 3 H 3 C S O O H 3 C CH 3 H 3 C IC50 = 190.0 nM 415.52 COc1ccc(OC)c(-n2nnc(S(=O)(=O)c3ccc(C(C)(C)C)cc3)c2C)c1 Homo sapiens CHEMBL4834539 single protein format
CHEMBL4856618 OBDepict N N N N S O O H 3 C CH 3 H 3 C O H 3 C CH 3 IC50 = 210.0 nM 410.5 COc1ccc(C)cc1-n1nnc(S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1C#N Homo sapiens CHEMBL4834539 single protein format
CHEMBL4853694 OBDepict CH 3 O CH 3 CH 3 S O O N N H 3 C N O O CH 3 H 3 C IC50 = 250.0 nM 473.6 CCCCOC(C)(C)c1ccc(S(=O)(=O)c2nnn(-c3cc(OC)ccc3OC)c2C)cc1 Homo sapiens CHEMBL4834543 cell-based format
CHEMBL4878794 OBDepict CH 3 O N N Cl N CH 3 S O O H 3 C CH 3 H 3 C IC50 = 250.0 nM 419.93 COc1ccc(Cl)cc1-n1nnc(S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1C Homo sapiens CHEMBL4834539 single protein format
CHEMBL4872210 OBDepict H 3 C O N N CH 3 N O CH 3 S O O H 3 C CH 3 H 3 C IC50 = 260.0 nM 427.53 COc1ccc(C)cc1-n1nnc(S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1C(C)=O Homo sapiens CHEMBL4834539 single protein format
CHEMBL4873947 OBDepict CH 3 O N N H 3 C N NH 2 S O O H 3 C CH 3 H 3 C IC50 = 280.0 nM 400.5 COc1ccc(C)cc1-n1nnc(S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1N Homo sapiens CHEMBL4834539 single protein format
CHEMBL4861132 OBDepict CH 3 O N N N CH 3 CH 3 CH 3 H 3 C S O O H 3 C CH 3 H 3 C IC50 = 300.0 nM 441.6 COc1ccc(C(C)(C)C)cc1-n1nnc(S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1C Homo sapiens CHEMBL4834539 single protein format
CHEMBL4849908 OBDepict N N N N S O O H 3 C CH 3 H 3 C O O H 3 C CH 3 IC50 = 300.0 nM 426.5 COc1ccc(OC)c(-n2nnc(S(=O)(=O)c3ccc(C(C)(C)C)cc3)c2C#N)c1 Homo sapiens CHEMBL4834539 single protein format
CHEMBL4847661 OBDepict H 3 C O N N Cl H 3 C H 3 C S O O H 3 C H 3 C CH 3 IC50 = 350.0 nM 432.97 COc1ccc(Cl)cc1-c1nc(C)c(S(=O)(=O)c2ccc(C(C)(C)C)cc2)n1C Homo sapiens CHEMBL4834539 single protein format
CHEMBL4879151 OBDepict H 3 C O N N N O N CH 3 CH 3 S O O H 3 C CH 3 H 3 C IC50 = 360.0 nM 440.53 COc1cc(-n2nnc(S(=O)(=O)c3ccc(C(C)(C)C)cc3)c2C)c(OC)cc1C#N Homo sapiens CHEMBL4834539 single protein format
CHEMBL4857525 OBDepict CH 3 O N N Br N CH 3 S O O H 3 C CH 3 H 3 C IC50 = 400.0 nM 464.39 COc1ccc(Br)cc1-n1nnc(S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1C Homo sapiens CHEMBL4834539 single protein format
CHEMBL4846228 OBDepict CH 3 O N N N CH 3 N S O O H 3 C CH 3 H 3 C IC50 = 400.0 nM 410.5 COc1ccc(C#N)cc1-n1nnc(S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1C Homo sapiens CHEMBL4834539 single protein format
CHEMBL4850195 OBDepict H 3 C O N N CH 3 H 3 C H 3 C S O O H 3 C H 3 C CH 3 IC50 = 400.0 nM 412.56 COc1ccc(C)cc1-c1nc(C)c(S(=O)(=O)c2ccc(C(C)(C)C)cc2)n1C Homo sapiens CHEMBL4834539 single protein format
CHEMBL4870712 OBDepict H 3 C O N N Cl N O CH 3 S O O H 3 C CH 3 H 3 C IC50 = 400.0 nM 447.94 COc1ccc(Cl)cc1-n1nnc(S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1C(C)=O Homo sapiens CHEMBL4834539 single protein format
CHEMBL4868841 OBDepict CH 3 O N N F N CH 3 S O O H 3 C CH 3 H 3 C IC50 = 400.0 nM 403.48 COc1ccc(F)cc1-n1nnc(S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1C Homo sapiens CHEMBL4834539 single protein format
CHEMBL4859314 OBDepict CH 3 O N O N H 3 C N CH 3 S O O O H 3 C CH 3 H 3 C IC50 = 400.0 nM 431.51 COc1ccc(OC)c(-n2nnc(S(=O)(=O)c3ccc(C(C)(C)OC)cc3)c2C)c1 Homo sapiens CHEMBL4834543 cell-based format
CHEMBL4875869 OBDepict CH 3 O N Cl N Cl N CH 3 S O O H 3 C CH 3 H 3 C IC50 = 400.0 nM 454.38 COc1cc(Cl)c(Cl)cc1-n1nnc(S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1C Homo sapiens CHEMBL4834539 single protein format
CHEMBL4850074 OBDepict CH 3 O N N N CH 3 F F F S O O H 3 C CH 3 H 3 C IC50 = 410.0 nM 453.49 COc1ccc(C(F)(F)F)cc1-n1nnc(S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1C Homo sapiens CHEMBL4834539 single protein format
CHEMBL4860882 OBDepict CH 3 O N O N H 3 C Cl N CH 3 S O O H 3 C CH 3 H 3 C IC50 = 470.0 nM 449.96 COc1cc(OC)c(-n2nnc(S(=O)(=O)c3ccc(C(C)(C)C)cc3)c2C)cc1Cl Homo sapiens CHEMBL4834539 single protein format
CHEMBL4850323 OBDepict H 3 C O N N Cl N S O O H 3 C CH 3 H 3 C IC50 = 480.0 nM 405.91 COc1ccc(Cl)cc1-n1cc(S(=O)(=O)c2ccc(C(C)(C)C)cc2)nn1 Homo sapiens CHEMBL4834539 single protein format
CHEMBL4858627 OBDepict H 3 C O N N CH 3 N S O O H 3 C CH 3 H 3 C IC50 = 500.0 nM 385.49 COc1ccc(C)cc1-n1cc(S(=O)(=O)c2ccc(C(C)(C)C)cc2)nn1 Homo sapiens CHEMBL4834539 single protein format
CHEMBL4871664 OBDepict CH 3 O N N Cl N NH 2 S O O H 3 C CH 3 H 3 C IC50 = 500.0 nM 420.92 COc1ccc(Cl)cc1-n1nnc(S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1N Homo sapiens CHEMBL4834539 single protein format
CHEMBL4876988 OBDepict H 3 C O N CH 3 N O N CH 3 CH 3 S O O H 3 C CH 3 H 3 C IC50 = 500.0 nM 429.54 COc1cc(-n2nnc(S(=O)(=O)c3ccc(C(C)(C)C)cc3)c2C)c(OC)cc1C Homo sapiens CHEMBL4834539 single protein format
CHEMBL4871806 OBDepict CH 3 O N N N CH 3 S O O H 3 C CH 3 H 3 C IC50 = 530.0 nM 385.49 COc1ccccc1-n1nnc(S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1C Homo sapiens CHEMBL4834539 single protein format
CHEMBL4877373 OBDepict CH 3 O N N Cl CH 3 S O O H 3 C CH 3 H 3 C IC50 = 550.0 nM 418.95 COc1ccc(Cl)cc1-c1ncc(S(=O)(=O)c2ccc(C(C)(C)C)cc2)n1C Homo sapiens CHEMBL4834539 single protein format
CHEMBL4869828 OBDepict CH 3 O N Br N Cl N CH 3 S O O H 3 C CH 3 H 3 C IC50 = 550.0 nM 498.83 COc1cc(Br)c(Cl)cc1-n1nnc(S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1C Homo sapiens CHEMBL4834539 single protein format
CHEMBL4868786 OBDepict CH 3 O N F N H 3 C N CH 3 S O O H 3 C CH 3 H 3 C IC50 = 600.0 nM 417.51 COc1cc(F)c(C)cc1-n1nnc(S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1C Homo sapiens CHEMBL4834539 single protein format
CHEMBL4872624 OBDepict CH 3 O N N N Cl N CH 3 S O O H 3 C CH 3 H 3 C IC50 = 600.0 nM 444.94 COc1cc(C#N)c(Cl)cc1-n1nnc(S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1C Homo sapiens CHEMBL4834539 single protein format
CHEMBL4859899 OBDepict CH 3 N N N S O O H 3 C CH 3 H 3 C O Cl H 3 C IC50 = 700.0 nM 433.96 CCc1c(S(=O)(=O)c2ccc(C(C)(C)C)cc2)nnn1-c1cc(Cl)ccc1OC Homo sapiens CHEMBL4834539 single protein format
CHEMBL4856961 OBDepict H 3 C O N Br N O N CH 3 CH 3 S O O H 3 C CH 3 H 3 C IC50 = 700.0 nM 494.41 COc1cc(-n2nnc(S(=O)(=O)c3ccc(C(C)(C)C)cc3)c2C)c(OC)cc1Br Homo sapiens CHEMBL4834539 single protein format
CHEMBL4875872 OBDepict CH 3 O N N CH 3 O N CH 3 H 3 C S O O H 3 C CH 3 H 3 C IC50 = 700.0 nM 443.57 CCc1cc(OC)c(-n2nnc(S(=O)(=O)c3ccc(C(C)(C)C)cc3)c2C)cc1OC Homo sapiens CHEMBL4834539 single protein format
CHEMBL4877224 OBDepict H 3 C O N N O N CH 3 O CH 3 S O O H 3 C CH 3 H 3 C IC50 = 700.0 nM 443.53 COc1ccc(OC)c(-n2nnc(S(=O)(=O)c3ccc(C(C)(C)C)cc3)c2C(C)=O)c1 Homo sapiens CHEMBL4834539 single protein format
CHEMBL4869913 OBDepict CH 3 O N Cl N H 3 C N CH 3 S O O H 3 C CH 3 H 3 C IC50 = 700.0 nM 433.96 COc1cc(Cl)c(C)cc1-n1nnc(S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1C Homo sapiens CHEMBL4834539 single protein format
CHEMBL4855078 OBDepict CH 3 O O Cl O H 3 C N N N CH 3 S O O H 3 C CH 3 H 3 C IC50 = 700.0 nM 477.97 COC(=O)c1cc(OC)c(-n2nnc(S(=O)(=O)c3ccc(C(C)(C)C)cc3)c2C)cc1Cl Homo sapiens CHEMBL4834539 single protein format
CHEMBL4852446 OBDepict CH 3 N N N S O O H 3 C CH 3 H 3 C O O H 3 C CH 3 IC50 = 800.0 nM 429.54 CCc1c(S(=O)(=O)c2ccc(C(C)(C)C)cc2)nnn1-c1cc(OC)ccc1OC Homo sapiens CHEMBL4834539 single protein format
CHEMBL4866481 OBDepict H 3 C O N N CH 3 H H 3 C S O O H 3 C H 3 C CH 3 IC50 = 800.0 nM 398.53 COc1ccc(C)cc1-c1nc(C)c(S(=O)(=O)c2ccc(C(C)(C)C)cc2)[nH]1 Homo sapiens CHEMBL4834539 single protein format
CHEMBL4874083 OBDepict CH 3 O N N H 3 C N CH 3 S O O H 3 C CH 3 H 3 C IC50 = 800.0 nM 399.52 COc1ccc(C)cc1-n1nnc(S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1C Homo sapiens CHEMBL4834539 single protein format
CHEMBL3632931 OBDepict CH 3 O N O N H 3 C S O IC50 = 850.0 nM 300.34 Cc1cc(-c2onc(C)c2C(=O)Sc2ccccc2)no1 Homo sapiens CHEMBL3635233 single protein format
CHEMBL1445606 OBDepict CH 3 S O CH 3 N O N O H 3 C IC50 = 850.0 nM 314.37 Cc1ccc(SC(=O)c2c(C)noc2-c2cc(C)on2)cc1 Homo sapiens CHEMBL3295049 cell-based format
CHEMBL4869893 OBDepict H 3 C O N Cl N O N CH 3 CH 3 S O O H 3 C CH 3 H 3 C IC50 = 900.0 nM 449.96 COc1cc(-n2nnc(S(=O)(=O)c3ccc(C(C)(C)C)cc3)c2C)c(OC)cc1Cl Homo sapiens CHEMBL4834539 single protein format
CHEMBL4855988 OBDepict H 3 C O N N O CH 3 O N CH 3 CH 3 S O O H 3 C CH 3 H 3 C IC50 = 900.0 nM 457.55 COc1cc(-n2nnc(S(=O)(=O)c3ccc(C(C)(C)C)cc3)c2C)c(OC)cc1C(C)=O Homo sapiens CHEMBL4834539 single protein format
CHEMBL4865234 OBDepict H 3 C O N N Cl H H 3 C S O O H 3 C H 3 C CH 3 IC50 = 900.0 nM 418.95 COc1ccc(Cl)cc1-c1nc(C)c(S(=O)(=O)c2ccc(C(C)(C)C)cc2)[nH]1 Homo sapiens CHEMBL4834539 single protein format
CHEMBL4852762 OBDepict CH 3 O N O N H 3 C N H 3 C S O O IC50 = 1000.0 nM 373.43 COc1ccc(OC)c(-n2nnc(S(=O)(=O)Cc3ccccc3)c2C)c1 Homo sapiens CHEMBL4834539 single protein format
CHEMBL4847628 OBDepict H 3 C O N N H 3 C CH 3 O N CH 3 CH 3 S O O H 3 C CH 3 H 3 C IC50 = 1000.0 nM 457.6 COc1cc(-n2nnc(S(=O)(=O)c3ccc(C(C)(C)C)cc3)c2C)c(OC)cc1C(C)C Homo sapiens CHEMBL4834539 single protein format
CHEMBL4859936 OBDepict CH 3 O N N H 3 C H 3 C N CH 3 S O O H 3 C CH 3 H 3 C IC50 = 1000.0 nM 427.57 CCc1cc(OC)c(-n2nnc(S(=O)(=O)c3ccc(C(C)(C)C)cc3)c2C)cc1C Homo sapiens CHEMBL4834539 single protein format
CHEMBL4851763 OBDepict CH 3 N N N S O O H 3 C CH 3 H 3 C O CH 3 H 3 C IC50 = 1000.0 nM 413.54 CCc1c(S(=O)(=O)c2ccc(C(C)(C)C)cc2)nnn1-c1cc(C)ccc1OC Homo sapiens CHEMBL4834539 single protein format