BDBM50005982 2,2-Dimethyl-dodecanoic acid (2-chloro-6-methyl-phenyl)-amide::CHEMBL43984

SMILES: CCCCCCCCCCC(C)(C)C(=O)Nc1c(C)cccc1Cl

InChI Key: InChIKey=MSWJVWGPYIIKFF-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 = 50005982   

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)	BDBM50005982 (2,2-Dimethyl-dodecanoic acid (2-chloro-6-methyl-ph...) Show SMILES CCCCCCCCCCC(C)(C)C(=O)Nc1c(C)cccc1Cl Show InChI InChI=1S/C21H34ClNO/c1-5-6-7-8-9-10-11-12-16-21(3,4)20(24)23-19-17(2)14-13-15-18(19)22/h13-15H,5-12,16H2,1-4H3,(H,23,24)	PDB Reactome pathway KEGG UniProtKB/TrEMBL DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	750	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description In vitro inhibition of acyl coenzyme A:cholesterol acyltransferase, in intestinal microsomes isolated from cholesterol-fed rabbits				J Med Chem 35: 1609-17 (1992) BindingDB Entry DOI: 10.7270/Q2G44QXN
					More data for this Ligand-Target Pair