Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sterol O-acyltransferase 1' and Ligand = 'BDBM50229240'   

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
Sterol O-acyltransferase 1 (Rattus norvegicus)	BDBM50229240 (CHEMBL417538) Show SMILES O=C1N(Cc2c1n(CSc1ccccc1)c1cc(nn1c2=O)-c1ccccc1)C1CCCCC1 Show InChI InChI=1S/C27H26N4O2S/c32-26-22-17-29(20-12-6-2-7-13-20)27(33)25(22)30(18-34-21-14-8-3-9-15-21)24-16-23(28-31(24)26)19-10-4-1-5-11-19/h1,3-5,8-11,14-16,20H,2,6-7,12-13,17-18H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	2.29E+4	n/a	n/a	n/a	n/a	n/a	n/a
Upjohn Company Curated by ChEMBL					Assay Description In vitro inhibition of Fu5AH acyl coenzyme A:cholesterol acyltransferase.				J Med Chem 34: 1721-7 (1991) BindingDB Entry DOI: 10.7270/Q2CC12X4
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