Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Acetylcholinesterase' and Ligand = 'BDBM50415461'   

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
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50415461 (CHEMBL589352) Show SMILES CN1CCC=C(C1)c1nsnc1OCCCOCCCCC(=O)NCCCCCCCCNc1c2CCCCc2nc2ccccc12 |c:4| Show InChI InChI=1S/C37H54N6O3S/c1-43-24-14-16-29(28-43)35-37(42-47-41-35)46-27-15-26-45-25-13-10-21-34(44)38-22-11-4-2-3-5-12-23-39-36-30-17-6-8-19-32(30)40-33-20-9-7-18-31(33)36/h6,8,16-17,19H,2-5,7,9-15,18,20-28H2,1H3,(H,38,44)(H,39,40)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.17	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				J Med Chem 53: 2094-103 (2010) Article DOI: 10.1021/jm901616h BindingDB Entry DOI: 10.7270/Q2KW5H8J
					More data for this Ligand-Target Pair