Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Acetylcholinesterase' and Ligand = 'BDBM50308515'   

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 (Homo sapiens (Human))	BDBM50308515 (2-Methoxy-7-methyl-2-oxo-2,3,4,5-tetrahydro-2lambd...) Show SMILES COC(=O)C1=C(C)OP(=O)(CCC1)OC |c:4| Show InChI InChI=1S/C9H15O5P/c1-7-8(9(10)12-2)5-4-6-15(11,13-3)14-7/h4-6H2,1-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.60E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Missouri St. Louis Curated by ChEMBL					Assay Description Inhibition of human AChE assessed as equilibrium binding by modified Ellman's spectrophotometric method				Bioorg Med Chem 18: 2265-74 (2010) Article DOI: 10.1016/j.bmc.2010.01.063 BindingDB Entry DOI: 10.7270/Q2RV0NTP
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50308515 (2-Methoxy-7-methyl-2-oxo-2,3,4,5-tetrahydro-2lambd...) Show SMILES COC(=O)C1=C(C)OP(=O)(CCC1)OC |c:4| Show InChI InChI=1S/C9H15O5P/c1-7-8(9(10)12-2)5-4-6-15(11,13-3)14-7/h4-6H2,1-3H3	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	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Missouri St. Louis Curated by ChEMBL					Assay Description Inhibition of human AChE by modified Ellman's spectrophotometric method				Bioorg Med Chem 18: 2265-74 (2010) Article DOI: 10.1016/j.bmc.2010.01.063 BindingDB Entry DOI: 10.7270/Q2RV0NTP
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50308515 (2-Methoxy-7-methyl-2-oxo-2,3,4,5-tetrahydro-2lambd...) Show SMILES COC(=O)C1=C(C)OP(=O)(CCC1)OC |c:4| Show InChI InChI=1S/C9H15O5P/c1-7-8(9(10)12-2)5-4-6-15(11,13-3)14-7/h4-6H2,1-3H3	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	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Missouri-St. Louis Curated by ChEMBL					Assay Description Inhibition of human AChE at pH 8				Bioorg Med Chem 23: 7529-34 (2015) Article DOI: 10.1016/j.bmc.2015.10.044 BindingDB Entry DOI: 10.7270/Q2N58QCW
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50308515 (2-Methoxy-7-methyl-2-oxo-2,3,4,5-tetrahydro-2lambd...) Show SMILES COC(=O)C1=C(C)OP(=O)(CCC1)OC |c:4| Show InChI InChI=1S/C9H15O5P/c1-7-8(9(10)12-2)5-4-6-15(11,13-3)14-7/h4-6H2,1-3H3	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	2.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Missouri-St. Louis Curated by ChEMBL					Assay Description Inhibition of human AChE at pH 6				Bioorg Med Chem 23: 7529-34 (2015) Article DOI: 10.1016/j.bmc.2015.10.044 BindingDB Entry DOI: 10.7270/Q2N58QCW
					More data for this Ligand-Target Pair