Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cholinesterase' and Ligand = 'BDBM50319388'   

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
Cholinesterase (Equus caballus (Horse))	BDBM50319388 (10-(4-((diethylamino)methyl)phenoxy)-N,N-dipropyld...) Show SMILES CCCN(CCC)CCCCCCCCCCOc1ccc(CN(CC)CC)cc1 Show InChI InChI=1S/C27H50N2O/c1-5-21-29(22-6-2)23-15-13-11-9-10-12-14-16-24-30-27-19-17-26(18-20-27)25-28(7-3)8-4/h17-20H,5-16,21-25H2,1-4H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	26	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of horse serum BChE after 15 mins by Ellman's method				Bioorg Med Chem Lett 20: 3254-8 (2010) Article DOI: 10.1016/j.bmcl.2010.04.059 BindingDB Entry DOI: 10.7270/Q2QC03P4
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