Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Acetylcholinesterase' and Ligand = 'BDBM50139049'   

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))	BDBM50139049 (CHEMBL3753732) Show SMILES COc1cccc(CCCCCCCCN2CCCC(C2)OC(C)=O)c1 Show InChI InChI=1S/C22H35NO3/c1-19(24)26-22-14-10-16-23(18-22)15-8-6-4-3-5-7-11-20-12-9-13-21(17-20)25-2/h9,12-13,17,22H,3-8,10-11,14-16,18H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.90E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bras£lia Curated by ChEMBL					Assay Description Non-competitive inhibition of electric eel acetylcholine esterase using acetylcholine iodide as substrate by Ellman's method				Eur J Med Chem 108: 687-700 (2016) Article DOI: 10.1016/j.ejmech.2015.12.024 BindingDB Entry DOI: 10.7270/Q20R9R7V
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50139049 (CHEMBL3753732) Show SMILES COc1cccc(CCCCCCCCN2CCCC(C2)OC(C)=O)c1 Show InChI InChI=1S/C22H35NO3/c1-19(24)26-22-14-10-16-23(18-22)15-8-6-4-3-5-7-11-20-12-9-13-21(17-20)25-2/h9,12-13,17,22H,3-8,10-11,14-16,18H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.61E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bras£lia Curated by ChEMBL					Assay Description Inhibition of electric eel acetylcholine esterase preincubated for 10 mins followed by the addition of acetylcholine iodide as substrate measured aft...				Eur J Med Chem 108: 687-700 (2016) Article DOI: 10.1016/j.ejmech.2015.12.024 BindingDB Entry DOI: 10.7270/Q20R9R7V
					More data for this Ligand-Target Pair