Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Acetylcholinesterase' and Ligand = 'BDBM50131717'   

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 (Tetronarce californica (Pacific electric ray) (Tor...)	BDBM50131717 (CHEMBL3633871) Show SMILES [Cl-].Clc1cccc(C[n+]2ccc(\C=C\C(=O)c3cc4ccccc4o3)cc2)c1Cl Show InChI InChI=1S/C23H16Cl2NO2.ClH/c24-19-6-3-5-18(23(19)25)15-26-12-10-16(11-13-26)8-9-20(27)22-14-17-4-1-2-7-21(17)28-22;/h1-14H,15H2;1H/q+1;/p-1/b9-8+;	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.12E+3	n/a	n/a	n/a	n/a	n/a	n/a
Alzahra University Curated by ChEMBL					Assay Description Inhibition of Torpedo californica AChE (type VI-S) using acetylthiocholine iodide as substrate assessed as 5-thio-2-nitrobenzoate anion formation pre...				Eur J Med Chem 103: 361-9 (2015) Article DOI: 10.1016/j.ejmech.2015.08.061 BindingDB Entry DOI: 10.7270/Q2XK8HC1
					More data for this Ligand-Target Pair