Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Acetylcholinesterase' and Ligand = 'BDBM50435272'   

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))	BDBM50435272 (CHEMBL2393225) Show SMILES Cc1cccc(Nc2ccccc2C(=O)NCCCC(=O)NCCCCCCCNc2c3CCCCc3nc3cc(Cl)ccc23)c1C Show InChI InChI=1S/C39H48ClN5O2/c1-27-14-12-19-33(28(27)2)44-35-18-9-7-16-32(35)39(47)43-25-13-20-37(46)41-23-10-4-3-5-11-24-42-38-30-15-6-8-17-34(30)45-36-26-29(40)21-22-31(36)38/h7,9,12,14,16,18-19,21-22,26,44H,3-6,8,10-11,13,15,17,20,23-25H2,1-2H3,(H,41,46)(H,42,45)(H,43,47)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.60	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Inhibition of electric eel AChE preincubated for 30 mins prior to horseradish peroxidase, H2O2 and DETAPAC addition measured for 20 mins under ROS co...				Bioorg Med Chem 21: 3614-23 (2013) Article DOI: 10.1016/j.bmc.2013.02.047 BindingDB Entry DOI: 10.7270/Q2WQ0557
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50435272 (CHEMBL2393225) Show SMILES Cc1cccc(Nc2ccccc2C(=O)NCCCC(=O)NCCCCCCCNc2c3CCCCc3nc3cc(Cl)ccc23)c1C Show InChI InChI=1S/C39H48ClN5O2/c1-27-14-12-19-33(28(27)2)44-35-18-9-7-16-32(35)39(47)43-25-13-20-37(46)41-23-10-4-3-5-11-24-42-38-30-15-6-8-17-34(30)45-36-26-29(40)21-22-31(36)38/h7,9,12,14,16,18-19,21-22,26,44H,3-6,8,10-11,13,15,17,20,23-25H2,1-2H3,(H,41,46)(H,42,45)(H,43,47)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.90	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine as substrate preincubated for 10 mins prior to substrate addition measured every 30 seconds f...				Bioorg Med Chem 21: 3614-23 (2013) Article DOI: 10.1016/j.bmc.2013.02.047 BindingDB Entry DOI: 10.7270/Q2WQ0557
					More data for this Ligand-Target Pair