Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Sterol O-acyltransferase 1' and Ligand = 'BDBM50450316'   

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)	BDBM50450316 (CHEMBL297991) Show SMILES CCCCCCCN(CCCCCSc1nc(O)cc(Cc2ccccc2)n1)C(=O)NC(C)C Show InChI InChI=1S/C27H42N4O2S/c1-4-5-6-7-12-17-31(27(33)28-22(2)3)18-13-9-14-19-34-26-29-24(21-25(32)30-26)20-23-15-10-8-11-16-23/h8,10-11,15-16,21-22H,4-7,9,12-14,17-20H2,1-3H3,(H,28,33)(H,29,30,32)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem		n/a	n/a	9.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
The DuPont Merck Pharmaceutical Company Curated by ChEMBL					Assay Description In vitro inhibition of acyl coenzyme A:cholesterol acyltransferase (ACAT) in rat hepatic microsomes by using AIV assay.				Bioorg Med Chem Lett 5: 167-72 (1995) BindingDB Entry DOI: 10.7270/Q2Z03833
					More data for this Ligand-Target Pair
Sterol O-acyltransferase 1 (Mus musculus)	BDBM50450316 (CHEMBL297991) Show SMILES CCCCCCCN(CCCCCSc1nc(O)cc(Cc2ccccc2)n1)C(=O)NC(C)C Show InChI InChI=1S/C27H42N4O2S/c1-4-5-6-7-12-17-31(27(33)28-22(2)3)18-13-9-14-19-34-26-29-24(21-25(32)30-26)20-23-15-10-8-11-16-23/h8,10-11,15-16,21-22H,4-7,9,12-14,17-20H2,1-3H3,(H,28,33)(H,29,30,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem		n/a	n/a	2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
The DuPont Merck Pharmaceutical Company Curated by ChEMBL					Assay Description Inhibition of acyl coenzyme A:cholesterol acyltransferase (ACAT) in J774 Macrophage cell culture by using J774 assay.				Bioorg Med Chem Lett 5: 167-72 (1995) BindingDB Entry DOI: 10.7270/Q2Z03833
					More data for this Ligand-Target Pair