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Found 1 hit Enz. Inhib. hit(s) with Target = '3-oxo-5-alpha-steroid 4-dehydrogenase 1/2' and Ligand = 'BDBM50020394'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
3-oxo-5-alpha-steroid 4-dehydrogenase 1/2


(Rattus norvegicus)		BDBM50020394
PNG
(CHEMBL1627710)
Show SMILES [H][C@@]12CC[C@H](C(=O)N(C(C)C)C(C)C)[C@@]1(C)CC[C@]1([H])c3ccc(C(O)=O)c(C)c3CC[C@@]21[H]
Show InChI InChI=1S/C16H23N3O3/c1-9(2)14(17)15(20)19-13(16(21)22)7-10-8-18-12-6-4-3-5-11(10)12/h3-6,8-14H,7,17H2,1-2H3,(H,19,20)(H,21,22)/t10?,11?,12?,13-,14-/m0/s1
MMDB

UniProtKB/SwissProt

B.MOAD
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CHEMBL
PC cid
PC sid
UniChem
PubMed
 7.00E+3n/an/an/an/an/an/an/an/a



Smith Kline& French Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Steroid 5-alpha-reductase of rat ventral prostate tissue

J Med Chem 33: 937-42 (1990)


BindingDB Entry DOI: 10.7270/Q2F76DR5
More data for this
Ligand-Target Pair