Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carboxylic ester hydrolase' and Ligand = 'BDBM50273182'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50273182 (5,6-Dimethoxy-2-(4-(3-(pyrrolidin-1-yl)propanoyl)p...) Show SMILES COc1cc2CC(Oc3ccc(cc3)C(=O)CCN3CCCC3)C(=O)c2cc1OC Show InChI InChI=1S/C24H27NO5/c1-28-21-13-17-14-23(24(27)19(17)15-22(21)29-2)30-18-7-5-16(6-8-18)20(26)9-12-25-10-3-4-11-25/h5-8,13,15,23H,3-4,9-12,14H2,1-2H3	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.04E+3	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BuchE in rat serum by Ellman's method				Bioorg Med Chem 16: 7646-53 (2008) Article DOI: 10.1016/j.bmc.2008.07.014 BindingDB Entry DOI: 10.7270/Q2RR1Z2W
					More data for this Ligand-Target Pair