Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Acetylcholinesterase' and Ligand = 'BDBM50318704'   

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 (Bos taurus (bovine))	BDBM50318704 (CHEMBL1084519 | Ethyl 5-Amino-2-methyl-6,7,8,9,10,...) Show SMILES CCOC(=O)c1cc2c(N)c3CCCCCCc3nc2nc1C Show InChI InChI=1S/C18H23N3O2/c1-3-23-18(22)13-10-14-16(19)12-8-6-4-5-7-9-15(12)21-17(14)20-11(13)2/h10H,3-9H2,1-2H3,(H2,19,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Autonoma de Madrid Curated by ChEMBL					Assay Description Displacement of propidium iodide from AChE in bovine erythrocytes after 15 mins by fluorescence plate reader				J Med Chem 53: 5129-43 (2010) Article DOI: 10.1021/jm901902w BindingDB Entry DOI: 10.7270/Q25T3MFV
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50318704 (CHEMBL1084519 | Ethyl 5-Amino-2-methyl-6,7,8,9,10,...) Show SMILES CCOC(=O)c1cc2c(N)c3CCCCCCc3nc2nc1C Show InChI InChI=1S/C18H23N3O2/c1-3-23-18(22)13-10-14-16(19)12-8-6-4-5-7-9-15(12)21-17(14)20-11(13)2/h10H,3-9H2,1-2H3,(H2,19,20,21)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Autonoma de Madrid Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				J Med Chem 53: 5129-43 (2010) Article DOI: 10.1021/jm901902w BindingDB Entry DOI: 10.7270/Q25T3MFV
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50318704 (CHEMBL1084519 | Ethyl 5-Amino-2-methyl-6,7,8,9,10,...) Show SMILES CCOC(=O)c1cc2c(N)c3CCCCCCc3nc2nc1C Show InChI InChI=1S/C18H23N3O2/c1-3-23-18(22)13-10-14-16(19)12-8-6-4-5-7-9-15(12)21-17(14)20-11(13)2/h10H,3-9H2,1-2H3,(H2,19,20,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Autonoma de Madrid Curated by ChEMBL					Assay Description Inhibition of AChE in human erythrocytes by Ellman's method				J Med Chem 53: 5129-43 (2010) Article DOI: 10.1021/jm901902w BindingDB Entry DOI: 10.7270/Q25T3MFV
					More data for this Ligand-Target Pair