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SMILES: C\C(=C/C(=O)Nc1ccc(C)cc1OCCCC(O)=O)c1ccc2n(ccc2c1)C(c1ccccc1)c1ccccc1

InChI Key: InChIKey=RBHJWANDTDNSSZ-WNAAXNPUSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50470302   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/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)		BDBM50470302
PNG
(CHEMBL29925)
Show SMILES C\C(=C/C(=O)Nc1ccc(C)cc1OCCCC(O)=O)c1ccc2n(ccc2c1)C(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C36H34N2O4/c1-25-15-17-31(33(22-25)42-21-9-14-35(40)41)37-34(39)23-26(2)29-16-18-32-30(24-29)19-20-38(32)36(27-10-5-3-6-11-27)28-12-7-4-8-13-28/h3-8,10-13,15-20,22-24,36H,9,14,21H2,1-2H3,(H,37,39)(H,40,41)/b26-23+
MMDB

UniProtKB/SwissProt

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GoogleScholar
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 14n/an/an/an/an/an/a



Kyowa Hakko Kogyo Co., Ltd

Curated by ChEMBL


Assay Description
Inhibitory activity against Steroid 5-alpha-reductase in prostates from male rats

J Med Chem 38: 2887-92 (1995)


Article DOI: 10.1021/jm00015a011
BindingDB Entry DOI: 10.7270/Q2B27Z0N
More data for this
Ligand-Target Pair