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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | 3-oxo-5-alpha-steroid 4-dehydrogenase 1 | ||
| Ligand | BDBM50031890 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_213114 (CHEMBL873905) | ||
| IC50 | 7500±n/a nM | ||
| Citation |  Jones, CD; Audia, JE; Lawhorn, DE; McQuaid, LA; Neubauer, BL; Pike, AJ; Pennington, PA; Stamm, NB; Toomey, RE; Hirsch, KS Nonsteroidal inhibitors of human type I steroid 5-alpha-reductase. J Med Chem36:421-3 (1993) [PubMed] | ||
| More Info.: | Get all data from this article, Assay Method | ||
| 3-oxo-5-alpha-steroid 4-dehydrogenase 1 | |||
| Name: | 3-oxo-5-alpha-steroid 4-dehydrogenase 1 | ||
| Synonyms: | 3-oxo-5-alpha-steroid 4-dehydrogenase 1 | 5α-Reductase 1 (5α-R1) | S5A1_HUMAN | S5AR | SR type 1 | SRD5A1 | Steroid 5-alpha-reductase | Steroid 5-alpha-reductase 1 | ||
| Type: | Enzyme | ||
| Mol. Mass.: | 29472.80 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P18405 | ||
| Residue: | 259 | ||
| Sequence: |
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| BDBM50031890 | |||
| n/a | |||
| Name | BDBM50031890 | ||
| Synonyms: | (10R,13S)-17-tert-Butylcarbamoyl-10,13-dimethyl-2,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3-carboxylic acid | (10R,13S,17S)-17-Diisopropylcarbamoyl-10,13-dimethyl-2,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3-carboxylic acid | (10R,13S,17S)-17-tert-Butylcarbamoyl-10,13-dimethyl-2,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3-carboxylic acid | (10R,14S)-17-tert-Butylcarbamoyl-10-methyl-13-(S)-methyl-2,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3-carboxylic acid | 17-tert-Butylcarbamoyl-10,13-dimethyl-2,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3-carboxylic acid | CHEMBL290823 | Epristeride | ||
| Type | Small organic molecule | ||
| Emp. Form. | C25H37NO3 | ||
| Mol. Mass. | 399.5662 | ||
| SMILES | [H][C@@]12CC[C@H](C(=O)NC(C)(C)C)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C=C(CC[C@]12C)C(O)=O |r,c:25,t:23| | ||
| Structure | 
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