Reaction Details
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3-oxo-5-alpha-steroid 4-dehydrogenase 1
Ligand
BDBM50180893
Substrate
n/a
Meas. Tech.
ChEMBL_327084 (CHEMBL859582)
pH
6.6±n/a
IC50
1450±n/a nM
Comments
extracted
Citation
Salem, OI; Frotscher, M; Scherer, C; Neugebauer, A; Biemel, K; Streiber, M; Maas, R; Hartmann, RW Novel 5alpha-reductase inhibitors: synthesis, structure-activity studies, and pharmacokinetic profile of phenoxybenzoylphenyl acetic acids. J Med Chem 49:748-59 (2006) [PubMed] Article More Info.:
Target
Name:
3-oxo-5-alpha-steroid 4-dehydrogenase 1
Synonyms:
S5A1_RAT | Srd5a1 | Steroid 5-alpha-reductase | Steroid 5-alpha-reductase 1
Type:
PROTEIN
Mol. Mass.:
29788.29
Organism:
Rattus norvegicus
Description:
ChEMBL_1441437
Residue:
259
Sequence:
MVPLMELDELCLLDMLVYLEGFMAFVSIVGLRSVGSPYGRYSPQWPGIRVPARPAWFIQELPSMAWPLYEYIRPAAARLGNLPNRVLLAMFLIHYVQRTLVFPVLIRGGKPTLLVTFVLAFLFCTFNGYVQSRYLSQFAVYAEDWVTHPCFLTGFALWLVGMVINIHSDHILRNLRKPGETGYKIPRGGLFEYVSAANYFGELVEWCGFALASWSLQGVVFALFTLSTLLTRAKQHHQWYHEKFEDYPKSRKILIPFVL
Inhibitor
Name:
BDBM50180893
Synonyms:
(3-methyl-4-(4-phenoxybenzoyl)phenyl)acetic acid | CHEMBL201762
Type:
Small organic molecule
Emp. Form.:
C22H18O4
Mol. Mass.:
346.3759
SMILES:
Cc1cc(CC(O)=O)ccc1C(=O)c1ccc(Oc2ccccc2)cc1
Structure:
