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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Glucocorticoid receptor | ||
| Ligand | BDBM50338740 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_726917 (CHEMBL1686706) | ||
| IC50 | 7.5±n/a nM | ||
| Citation |  Roach, SL; Higuchi, RI; Hudson, AR; Vassar, A; Grant, VH; Lamer, R; Hooper, C; Rungta, D; Syka, PM; Mais, DE; Marschke, KB; Zhi, L Tetrahydroquinolin-3-yl carbamate glucocorticoid receptor agonists with reduced PEPCK activation. Bioorg Med Chem Lett21:1658-62 (2011) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Glucocorticoid receptor | |||
| Name: | Glucocorticoid receptor | ||
| Synonyms: | GCR_HUMAN | GR | GRL | Glucocorticoid | Glucocorticoid receptor (GRFP) | NR3C1 | Nuclear receptor subfamily 3 group C member 1 | ||
| Type: | Enzyme | ||
| Mol. Mass.: | 85656.87 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P04150 | ||
| Residue: | 777 | ||
| Sequence: |
| ||
| BDBM50338740 | |||
| n/a | |||
| Name | BDBM50338740 | ||
| Synonyms: | (3R,4S)-5,7-difluoro-6-(1H-indol-7-yl)-2,2,4-trimethyl-1,2,3,4-tetrahydroquinolin-3-yl 3-chloro-4-methoxyphenylcarbamate | CHEMBL1684349 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C28H26ClF2N3O3 | ||
| Mol. Mass. | 525.974 | ||
| SMILES | COc1ccc(NC(=O)O[C@@H]2[C@@H](C)c3c(F)c(c(F)cc3NC2(C)C)-c2cccc3cc[nH]c23)cc1Cl |r,wU:10.9,wD:11.11,(19.96,-9.41,;18.63,-10.18,;17.3,-9.4,;15.96,-10.17,;14.63,-9.4,;14.64,-7.86,;13.3,-7.08,;11.97,-7.85,;11.96,-9.39,;10.64,-7.08,;9.3,-7.84,;7.96,-7.07,;7.96,-5.53,;6.63,-7.84,;5.29,-7.08,;5.29,-5.54,;3.96,-7.85,;3.96,-9.39,;2.63,-10.16,;5.3,-10.16,;6.63,-9.39,;7.96,-10.16,;9.3,-9.39,;10.06,-10.73,;10.84,-9.4,;2.63,-7.08,;2.64,-5.54,;1.3,-4.77,;-.03,-5.54,;-.03,-7.09,;-1.15,-8.13,;-.52,-9.52,;1,-9.35,;1.31,-7.85,;15.96,-7.09,;17.3,-7.86,;18.63,-7.08,)| | ||
| Structure | 
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