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Found 1 hit Enz. Inhib. hit(s) with Target = '3-oxo-5-alpha-steroid 4-dehydrogenase 1' and Ligand = 'BDBM50157220'   
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


(Homo sapiens (Human))		BDBM50157220
PNG
(4-Methyl-3-oxo-2,3,5,6-tetrahydro-1H-pyrido[1,2-a]...)
Show SMILES CC(=O)Nc1ccc(OC(=O)c2ccc3N4CCC(=O)C(C)=C4CCc3c2)cc1 |c:21|
Show InChI InChI=1S/C23H22N2O4/c1-14-20-9-3-16-13-17(4-10-21(16)25(20)12-11-22(14)27)23(28)29-19-7-5-18(6-8-19)24-15(2)26/h4-8,10,13H,3,9,11-12H2,1-2H3,(H,24,26)
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n/an/a 707n/an/an/an/an/an/a



Polo Scientifico Università di Firenze

Curated by ChEMBL


Assay Description
Inhibitory concentration against human steroid 5-alpha-reductase I receptor expressed in CHO 1827 cells

Bioorg Med Chem Lett 15: 145-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.10.017
BindingDB Entry DOI: 10.7270/Q2ZK5G4N
More data for this
Ligand-Target Pair