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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Mineralocorticoid receptor | ||
| Ligand | BDBM50235945 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1658407 (CHEMBL4008019) | ||
| IC50 | 6.50±n/a nM | ||
| Citation |  Martín-Martínez, M; Pérez-Gordillo, FL; Álvarez de la Rosa, D; Rodríguez, Y; Gerona-Navarro, G; González-Muñiz, R; Zhou, MM Modulating Mineralocorticoid Receptor with Non-steroidal Antagonists. New Opportunities for the Development of Potent and Selective Ligands without Off-Target Side Effects. J Med Chem60:2629-2650 (2017) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Mineralocorticoid receptor | |||
| Name: | Mineralocorticoid receptor | ||
| Synonyms: | MCR | MCR_HUMAN | MLR | MR | NR3C2 | Nuclear receptor subfamily 3 group C member 2 | ||
| Type: | Enzyme | ||
| Mol. Mass.: | 107076.42 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P08235 | ||
| Residue: | 984 | ||
| Sequence: |
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| BDBM50235945 | |||
| n/a | |||
| Name | BDBM50235945 | ||
| Synonyms: | CHEMBL4068898 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C22H20F4N2O4S | ||
| Mol. Mass. | 484.464 | ||
| SMILES | Cc1c(cc(CCF)n1-c1ccc(F)cc1OC(F)F)C(=O)Nc1ccc(cc1)S(C)(=O)=O |(49.68,-18.43,;49.68,-19.97,;48.44,-20.87,;48.91,-22.34,;50.45,-22.34,;51.35,-23.59,;50.72,-24.99,;51.63,-26.24,;50.93,-20.87,;52.39,-20.4,;53.53,-21.43,;54.99,-20.96,;55.32,-19.45,;56.78,-18.98,;54.16,-18.42,;52.7,-18.9,;51.56,-17.87,;51.87,-16.36,;50.72,-15.34,;53.33,-15.88,;46.97,-20.4,;46.65,-18.89,;45.83,-21.43,;44.36,-20.95,;44.05,-19.45,;42.59,-18.97,;41.44,-20,;41.77,-21.51,;43.23,-21.98,;39.97,-19.52,;38.83,-20.56,;39.19,-18.18,;40.74,-18.18,)| | ||
| Structure | 
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