BDBM50047515 CHEMBL46738::Hexanoic acid {2-dimethylamino-6-[3-(4-phenyl-imidazol-1-yl)-propoxy]-phenyl}-amide

SMILES: CCCCCC(=O)Nc1c(OCCCn2cnc(c2)-c2ccccc2)cccc1N(C)C

InChI Key: InChIKey=JJZDMZHYPPAQNX-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50047515   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Acyl-CoA:cholesterol acyltransferase (Oryctolagus cuniculus)	BDBM50047515 (CHEMBL46738 | Hexanoic acid {2-dimethylamino-6-[3-...) Show SMILES CCCCCC(=O)Nc1c(OCCCn2cnc(c2)-c2ccccc2)cccc1N(C)C Show InChI InChI=1S/C26H34N4O2/c1-4-5-7-16-25(31)28-26-23(29(2)3)14-10-15-24(26)32-18-11-17-30-19-22(27-20-30)21-12-8-6-9-13-21/h6,8-10,12-15,19-20H,4-5,7,11,16-18H2,1-3H3,(H,28,31)	PDB Reactome pathway KEGG UniProtKB/TrEMBL DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	100	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)	BDBM50047515 (CHEMBL46738 | Hexanoic acid {2-dimethylamino-6-[3-...) Show SMILES CCCCCC(=O)Nc1c(OCCCn2cnc(c2)-c2ccccc2)cccc1N(C)C Show InChI InChI=1S/C26H34N4O2/c1-4-5-7-16-25(31)28-26-23(29(2)3)14-10-15-24(26)32-18-11-17-30-19-22(27-20-30)21-12-8-6-9-13-21/h6,8-10,12-15,19-20H,4-5,7,11,16-18H2,1-3H3,(H,28,31)	PDB Reactome pathway KEGG UniProtKB/TrEMBL DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	200	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 intestine microsomes.				J Med Chem 36: 1630-40 (1993) BindingDB Entry DOI: 10.7270/Q22B8X4P
					More data for this Ligand-Target Pair