BDBM50081700 6-Chloro-3-(2-cyclohexyl-ethyl)-pyran-2-one::CHEMBL134339

SMILES: Clc1ccc(CCC2CCCCC2)c(=O)o1

InChI Key: InChIKey=DVPWHXXSWGHZOL-UHFFFAOYSA-N

Data: 1 KI

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 = 50081700   

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
Cholesterol esterase (Homo sapiens (Human))	BDBM50081700 (6-Chloro-3-(2-cyclohexyl-ethyl)-pyran-2-one | CHEM...) Show SMILES Clc1ccc(CCC2CCCCC2)c(=O)o1 Show InChI InChI=1S/C13H17ClO2/c14-12-9-8-11(13(15)16-12)7-6-10-4-2-1-3-5-10/h8-10H,1-7H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of New Mexico Curated by ChEMBL					Assay Description Inhibition of the Pancreatic Cholesterol Esterase from porcine				J Med Chem 42: 4250-6 (1999) BindingDB Entry DOI: 10.7270/Q2KP81C5
					More data for this Ligand-Target Pair