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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Mineralocorticoid receptor | ||
| Ligand | BDBM50398059 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1658407 (CHEMBL4008019) | ||
| IC50 | 9.4±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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| BDBM50398059 | |||
| n/a | |||
| Name | BDBM50398059 | ||
| Synonyms: | CHEMBL2181932 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C22H21F3N2O4S | ||
| Mol. Mass. | 466.473 | ||
| SMILES | Cc1c(cn(CCO)c1-c1ccccc1C(F)(F)F)C(=O)Nc1ccc(cc1)S(C)(=O)=O |(34.95,-31.12,;34.48,-32.58,;33,-33.06,;33.01,-34.59,;34.47,-35.07,;34.85,-36.57,;33.75,-37.64,;34.13,-39.14,;35.38,-33.82,;36.92,-33.83,;37.69,-32.5,;39.22,-32.5,;40,-33.83,;39.22,-35.17,;37.68,-35.17,;36.92,-36.49,;35.38,-36.49,;37.68,-37.83,;36.13,-37.83,;31.76,-32.15,;31.76,-30.61,;30.43,-32.92,;29.09,-32.16,;27.76,-32.93,;26.42,-32.16,;26.42,-30.61,;27.75,-29.84,;29.08,-30.6,;25.09,-29.84,;25.08,-28.3,;24.31,-31.17,;23.55,-29.84,)| | ||
| Structure | 
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