Reaction Details | |||
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Target | Nuclear receptor ROR-gamma | ||
Ligand | BDBM50105991 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_1506251 (CHEMBL3599135) | ||
EC50 | 134±n/a nM | ||
Citation | Wang, T; Banerjee, D; Bohnert, T; Chao, J; Enyedy, I; Fontenot, J; Guertin, K; Jones, H; Lin, EY; Marcotte, D; Talreja, T; Van Vloten, K Discovery of novel pyrazole-containing benzamides as potent ROR¿ inverse agonists. Bioorg Med Chem Lett25:2985-90 (2015) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Nuclear receptor ROR-gamma | |||
Name: | Nuclear receptor ROR-gamma | ||
Synonyms: | Nr1f3 | Nuclear receptor RZR-gamma | Nuclear receptor subfamily 1 group F member 3 | RAR-related orphan receptor C | RORG_MOUSE | Retinoid-related orphan receptor-gamma | Rorc | Rorg | TOR | Thor | Thymus orphan receptor | ||
Type: | PROTEIN | ||
Mol. Mass.: | 58133.31 | ||
Organism: | Mus musculus | ||
Description: | ChEMBL_103664 | ||
Residue: | 516 | ||
Sequence: |
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BDBM50105991 | |||
n/a | |||
Name | BDBM50105991 | ||
Synonyms: | CHEMBL3598060 | ||
Type | Small organic molecule | ||
Emp. Form. | C30H33ClFN5O3 | ||
Mol. Mass. | 569.085 | ||
SMILES | [2H]C([2H])([2H])N(C(=O)c1c(F)cccc1Cl)c1ccc(cc1N1CC2CC2C1)-c1cc(NC(=O)[C@H]2C[C@H](O)C2)nn1C(C)C |r,wU:33.36,wD:35.39,(.26,3.23,;1.33,3.85,;.26,4.46,;1.32,4.88,;2.66,3.08,;2.67,1.54,;3.73,.93,;1.33,.77,;1.33,-.77,;2.4,-1.39,;,-1.54,;-1.33,-.77,;-1.33,.77,;,1.54,;,2.77,;4,3.86,;5.33,3.09,;6.66,3.86,;6.66,5.4,;5.33,6.17,;4,5.4,;2.66,6.17,;1.44,5.49,;.22,6.2,;.22,7.6,;1.43,8.27,;2.65,7.56,;8,6.17,;8.14,7.69,;9.64,8.01,;10.27,9.42,;11.8,9.58,;12.53,8.58,;12.43,10.98,;11.85,12.37,;13.29,12.93,;13.79,14.05,;13.85,11.49,;10.42,6.68,;9.39,5.53,;9.7,4.03,;10.87,3.64,;8.78,3.21,)| | ||
Structure |