Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '3-oxo-5-alpha-steroid 4-dehydrogenase 1' and Ligand = 'BDBM50046528'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
3-oxo-5-alpha-steroid 4-dehydrogenase 1 (Rattus norvegicus)	BDBM50046528 (CHEMBL3309453) Show SMILES [#6]\[#6](-[#6])=[#6]-1/[#6]\[#6]=[#6](-[#6])/[#6]-[#6]\[#6]=[#6](-[#6])/[#6]-[#6]-1=O |t:5,10| Show InChI InChI=1S/C15H22O/c1-11(2)14-9-8-12(3)6-5-7-13(4)10-15(14)16/h7-8H,5-6,9-10H2,1-4H3/b12-8-,13-7-	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.94E+6	n/a	n/a	n/a	n/a	n/a	n/a
Naresuan University Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat liver steroid 5-alpha-reductase assessed as inhibition of testosterone conversion to dihydrotestosterone incubated f...				Bioorg Med Chem Lett 24: 3526-9 (2014) Article DOI: 10.1016/j.bmcl.2014.05.057 BindingDB Entry DOI: 10.7270/Q2PG1TCW
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