Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Acetylcholinesterase' and Ligand = 'BDBM50298427'   

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))	BDBM50298427 (1-(2-nitro benzene)-sulfonyl-cis-2,6-dimethylpiper...) Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1ccccc1[N+]([O-])=O |r| Show InChI InChI=1S/C13H18N2O4S/c1-10-6-5-7-11(2)14(10)20(18,19)13-9-4-3-8-12(13)15(16)17/h3-4,8-11H,5-7H2,1-2H3/t10-,11+	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				Eur J Med Chem 44: 4057-62 (2009) Article DOI: 10.1016/j.ejmech.2009.04.042 BindingDB Entry DOI: 10.7270/Q2MK6CZF
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50298427 (1-(2-nitro benzene)-sulfonyl-cis-2,6-dimethylpiper...) Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1ccccc1[N+]([O-])=O |r| Show InChI InChI=1S/C13H18N2O4S/c1-10-6-5-7-11(2)14(10)20(18,19)13-9-4-3-8-12(13)15(16)17/h3-4,8-11H,5-7H2,1-2H3/t10-,11+	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	185	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of human serum AChE by Ellman's assay				Eur J Med Chem 44: 4057-62 (2009) Article DOI: 10.1016/j.ejmech.2009.04.042 BindingDB Entry DOI: 10.7270/Q2MK6CZF
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50298427 (1-(2-nitro benzene)-sulfonyl-cis-2,6-dimethylpiper...) Show SMILES C[C@H]1CCC[C@@H](C)N1S(=O)(=O)c1ccccc1[N+]([O-])=O |r| Show InChI InChI=1S/C13H18N2O4S/c1-10-6-5-7-11(2)14(10)20(18,19)13-9-4-3-8-12(13)15(16)17/h3-4,8-11H,5-7H2,1-2H3/t10-,11+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	195	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of Wistar rat brain homogenate AChE by Ellman's assay				Eur J Med Chem 44: 4057-62 (2009) Article DOI: 10.1016/j.ejmech.2009.04.042 BindingDB Entry DOI: 10.7270/Q2MK6CZF
					More data for this Ligand-Target Pair