Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Acetylcholinesterase' and Ligand = 'BDBM50318702'   

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))	BDBM50318702 (CHEMBL1084518 | Ethyl 5-Amino-2-methyl-7,8-dihydro...) Show SMILES CCOC(=O)c1cc2c(N)c3CCCc3nc2nc1C Show InChI InChI=1S/C15H17N3O2/c1-3-20-15(19)10-7-11-13(16)9-5-4-6-12(9)18-14(11)17-8(10)2/h7H,3-6H2,1-2H3,(H2,16,17,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	350	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))	BDBM50318702 (CHEMBL1084518 | Ethyl 5-Amino-2-methyl-7,8-dihydro...) Show SMILES CCOC(=O)c1cc2c(N)c3CCCc3nc2nc1C Show InChI InChI=1S/C15H17N3O2/c1-3-20-15(19)10-7-11-13(16)9-5-4-6-12(9)18-14(11)17-8(10)2/h7H,3-6H2,1-2H3,(H2,16,17,18)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	350	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))	BDBM50318702 (CHEMBL1084518 | Ethyl 5-Amino-2-methyl-7,8-dihydro...) Show SMILES CCOC(=O)c1cc2c(N)c3CCCc3nc2nc1C Show InChI InChI=1S/C15H17N3O2/c1-3-20-15(19)10-7-11-13(16)9-5-4-6-12(9)18-14(11)17-8(10)2/h7H,3-6H2,1-2H3,(H2,16,17,18)	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	2.10E+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