Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Acyl-CoA desaturase 1' and Ligand = 'BDBM50371087'   

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
Acyl-CoA desaturase 1 (Mus musculus)	BDBM50371087 (CHEMBL375514) Show SMILES Cc1nnc([nH]1)-c1ccc(nn1)N1CCC(CC1)Oc1cc(F)ccc1Cl Show InChI InChI=1S/C18H18ClFN6O/c1-11-21-18(25-22-11)15-4-5-17(24-23-15)26-8-6-13(7-9-26)27-16-10-12(20)2-3-14(16)19/h2-5,10,13H,6-9H2,1H3,(H,21,22,25)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of SCD1 in ob/ob mouse liver microsome				J Med Chem 50: 3086-100 (2007) Article DOI: 10.1021/jm070219p BindingDB Entry DOI: 10.7270/Q2GH9JSG
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