BDBM50081698 6-Chloro-5-(2-cyclohexyl-ethyl)-pyran-2-one::CHEMBL135891

SMILES: Clc1oc(=O)ccc1CCC1CCCCC1

InChI Key: InChIKey=PEZSJIURMXBBJF-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 = 50081698   

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))	BDBM50081698 (6-Chloro-5-(2-cyclohexyl-ethyl)-pyran-2-one | CHEM...) Show SMILES Clc1oc(=O)ccc1CCC1CCCCC1 Show InChI InChI=1S/C13H17ClO2/c14-13-11(8-9-12(15)16-13)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 Similars	PubMed	58	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