Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Acetylcholinesterase' and Ligand = 'BDBM50280624'   

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))	BDBM50280624 (6-chloro-10-azatetracyclo[10.2.1.02,11.04,9]pentad...) Show SMILES Nc1c2C3CCC(C3)c2nc2ccc(Cl)cc12 Show InChI InChI=1S/C14H13ClN2/c15-9-3-4-11-10(6-9)13(16)12-7-1-2-8(5-7)14(12)17-11/h3-4,6-8H,1-2,5H2,(H2,16,17)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	78	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase (AChE) in electric eel (type V-S) by modified radiometric assay				Bioorg Med Chem Lett 2: 861-864 (1992) Article DOI: 10.1016/S0960-894X(00)80545-4 BindingDB Entry DOI: 10.7270/Q29886XS
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50280624 (6-chloro-10-azatetracyclo[10.2.1.02,11.04,9]pentad...) Show SMILES Nc1c2C3CCC(C3)c2nc2ccc(Cl)cc12 Show InChI InChI=1S/C14H13ClN2/c15-9-3-4-11-10(6-9)13(16)12-7-1-2-8(5-7)14(12)17-11/h3-4,6-8H,1-2,5H2,(H2,16,17)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universitat de Barcelona Curated by ChEMBL					Assay Description In vitro inhibitory activity against human erythrocyte acetylcholinesterase				J Med Chem 47: 4471-82 (2004) Article DOI: 10.1021/jm049877p BindingDB Entry DOI: 10.7270/Q26974WJ
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50280624 (6-chloro-10-azatetracyclo[10.2.1.02,11.04,9]pentad...) Show SMILES Nc1c2C3CCC(C3)c2nc2ccc(Cl)cc12 Show InChI InChI=1S/C14H13ClN2/c15-9-3-4-11-10(6-9)13(16)12-7-1-2-8(5-7)14(12)17-11/h3-4,6-8H,1-2,5H2,(H2,16,17)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase (AChE) of human red blood cell (type XIII) by modified radiometric AChE assay				Bioorg Med Chem Lett 2: 861-864 (1992) Article DOI: 10.1016/S0960-894X(00)80545-4 BindingDB Entry DOI: 10.7270/Q29886XS
					More data for this Ligand-Target Pair