Search and Browse
Download
Enter Data
| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Glucocorticoid receptor | ||
| Ligand | BDBM50338741 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_726914 (CHEMBL1686703) | ||
| EC50 | 5.8±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: |
| ||
| BDBM50338741 | |||
| n/a | |||
| Name | BDBM50338741 | ||
| Synonyms: | (3R,4S)-6-(3-chloro-1H-indol-7-yl)-5,7-difluoro-2,2,4-trimethyl-1,2,3,4-tetrahydroquinolin-3-yl 3-chloro-4-methoxyphenylcarbamate | CHEMBL1684350 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C28H25Cl2F2N3O3 | ||
| Mol. Mass. | 560.419 | ||
| SMILES | COc1ccc(NC(=O)O[C@@H]2[C@@H](C)c3c(F)c(c(F)cc3NC2(C)C)-c2cccc3c(Cl)c[nH]c23)cc1Cl |r,wU:10.9,wD:11.11,(36.62,-.13,;35.28,-.9,;33.95,-.12,;32.61,-.89,;31.28,-.12,;31.29,1.42,;29.96,2.19,;28.62,1.43,;28.62,-.11,;27.29,2.2,;25.95,1.43,;24.61,2.21,;24.61,3.75,;23.28,1.44,;21.95,2.2,;21.94,3.74,;20.62,1.43,;20.61,-.11,;19.28,-.88,;21.95,-.88,;23.28,-.11,;24.61,-.88,;25.95,-.11,;27.49,-.11,;25.94,-1.65,;19.28,2.2,;19.29,3.74,;17.96,4.51,;16.62,3.74,;16.63,2.18,;15.5,1.15,;13.99,1.46,;16.13,-.24,;17.66,-.07,;17.96,1.43,;32.62,2.19,;33.95,1.42,;35.28,2.19,)| | ||
| Structure | 
| ||