BDBM50454951 CHEMBL312095

SMILES: Cc1nc(cs1)-c1cccc(CN(C2CCCCCC2)C(=O)Nc2c(C)cc(C)cc2C)c1

InChI Key: InChIKey=RCQVXWILKCRFMY-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50454951   

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)	BDBM50454951 (CHEMBL312095) Show SMILES Cc1nc(cs1)-c1cccc(CN(C2CCCCCC2)C(=O)Nc2c(C)cc(C)cc2C)c1 Show InChI InChI=1S/C28H35N3OS/c1-19-14-20(2)27(21(3)15-19)30-28(32)31(25-12-7-5-6-8-13-25)17-23-10-9-11-24(16-23)26-18-33-22(4)29-26/h9-11,14-16,18,25H,5-8,12-13,17H2,1-4H3,(H,30,32)	PDB Reactome pathway KEGG UniProtKB/TrEMBL DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
Fujisawa Pharmaceutical Co. Ltd. Curated by ChEMBL					Assay Description In vitro inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase (ACAT) in rabbit intestinal microsomes				J Med Chem 41: 2390-410 (1998) Article DOI: 10.1021/jm9800853 BindingDB Entry DOI: 10.7270/Q2MW2G7V
					More data for this Ligand-Target Pair