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Target
3-oxo-5-alpha-steroid 4-dehydrogenase 1
Ligand
BDBM50102597
Substrate
n/a
Meas. Tech.
ChEMBL_1441437 (CHEMBL3373392)
IC50
94500±n/a nM
Citation
 Bratoeff, E; Garrido, M; Ramírez-Apan, T; Heuze, Y; Sánchez, A; Soriano, J; Cabeza, M Effect of dehydroepiandrosterone derivatives on the activity of 5a-reductase isoenzymes and on cancer cell line PC-3. Bioorg Med Chem 22:6233-41 (2014) [PubMed]  Article 
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:
BDBM50102597
Synonyms:
CHEMBL3342904
Type:
Small organic molecule
Emp. Form.:
C30H33BrN2O3
Mol. Mass.:
549.499
SMILES:
[H][C@@]12CC(C=O)=C(n3ccnc3)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@H](CC[C@]12C)OC(=O)c1ccc(Br)cc1 |r,t:5,24|
Structure:
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