Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Acyl-CoA:cholesterol acyltransferase' and Ligand = 'BDBM50047516'   

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:cholesterol acyltransferase (Oryctolagus cuniculus)	BDBM50047516 (1-{2-Dimethylamino-6-[3-(4-phenyl-imidazol-1-yl)-p...) Show SMILES CCCCCNC(=O)N(C)c1c(OCCCn2cnc(c2)-c2ccccc2)cccc1N(C)C Show InChI InChI=1S/C27H37N5O2/c1-5-6-10-17-28-27(33)31(4)26-24(30(2)3)15-11-16-25(26)34-19-12-18-32-20-23(29-21-32)22-13-8-7-9-14-22/h7-9,11,13-16,20-21H,5-6,10,12,17-19H2,1-4H3,(H,28,33)	PDB Reactome pathway KEGG UniProtKB/TrEMBL DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
Eisai Company, Ltd. Curated by ChEMBL					Assay Description Tested for inhibition against acyl coenzyme A:cholesterol acyltransferase from rabbit aorta homogenate.				J Med Chem 36: 1630-40 (1993) BindingDB Entry DOI: 10.7270/Q22B8X4P
					More data for this Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase (Oryctolagus cuniculus)	BDBM50047516 (1-{2-Dimethylamino-6-[3-(4-phenyl-imidazol-1-yl)-p...) Show SMILES CCCCCNC(=O)N(C)c1c(OCCCn2cnc(c2)-c2ccccc2)cccc1N(C)C Show InChI InChI=1S/C27H37N5O2/c1-5-6-10-17-28-27(33)31(4)26-24(30(2)3)15-11-16-25(26)34-19-12-18-32-20-23(29-21-32)22-13-8-7-9-14-22/h7-9,11,13-16,20-21H,5-6,10,12,17-19H2,1-4H3,(H,28,33)	PDB Reactome pathway KEGG UniProtKB/TrEMBL DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	930	n/a	n/a	n/a	n/a	n/a	n/a
Eisai Company, Ltd. Curated by ChEMBL					Assay Description Tested for inhibition against acyl coenzyme A:cholesterol acyltransferase from rabbit aorta homogenate.				J Med Chem 36: 1630-40 (1993) BindingDB Entry DOI: 10.7270/Q22B8X4P
					More data for this Ligand-Target Pair