null

SMILES: COc1cccc2cc(C(=O)\C=C\c3cc[n+](Cc4cccc(Cl)c4Cl)cc3)c(=O)oc12

InChI Key: InChIKey=FQSJWFBWGRXAMA-CMDGGOBGSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50402585   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50402585 (CHEMBL2206121) Show SMILES COc1cccc2cc(C(=O)\C=C\c3cc[n+](Cc4cccc(Cl)c4Cl)cc3)c(=O)oc12 Show InChI InChI=1S/C25H18Cl2NO4/c1-31-22-7-3-4-17-14-19(25(30)32-24(17)22)21(29)9-8-16-10-12-28(13-11-16)15-18-5-2-6-20(26)23(18)27/h2-14H,15H2,1H3/q+1/b9-8+	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
University College of Science Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate by Ellman's method				Bioorg Med Chem 20: 7214-22 (2012) Article DOI: 10.1016/j.bmc.2012.08.052 BindingDB Entry DOI: 10.7270/Q2SQ91J0
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50402585 (CHEMBL2206121) Show SMILES COc1cccc2cc(C(=O)\C=C\c3cc[n+](Cc4cccc(Cl)c4Cl)cc3)c(=O)oc12 Show InChI InChI=1S/C25H18Cl2NO4/c1-31-22-7-3-4-17-14-19(25(30)32-24(17)22)21(29)9-8-16-10-12-28(13-11-16)15-18-5-2-6-20(26)23(18)27/h2-14H,15H2,1H3/q+1/b9-8+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
University College of Science Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using acetylthiocholine iodide as substrate by Ellman's method				Bioorg Med Chem 20: 7214-22 (2012) Article DOI: 10.1016/j.bmc.2012.08.052 BindingDB Entry DOI: 10.7270/Q2SQ91J0
					More data for this Ligand-Target Pair