Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cholinesterase' and Ligand = 'BDBM50346415'   

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
Cholinesterase (Equus caballus (Horse))	BDBM50346415 (6-chloro-2-methoxy-N-(((1S,9aR)-octahydro-1H-quino...) Show SMILES COc1ccc2nc3cc(Cl)ccc3c(NC[C@@H]3CCCN4CCCC[C@H]34)c2c1 |r| Show InChI InChI=1S/C24H28ClN3O/c1-29-18-8-10-21-20(14-18)24(19-9-7-17(25)13-22(19)27-21)26-15-16-5-4-12-28-11-3-2-6-23(16)28/h7-10,13-14,16,23H,2-6,11-12,15H2,1H3,(H,26,27)/t16-,23+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	870	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Genova Curated by ChEMBL					Assay Description Inhibition of Equine serum BChE using butyrylthiocoline iodide as a substrate after 20 mins by Ellman's assay				Eur J Med Chem 46: 2170-84 (2011) Article DOI: 10.1016/j.ejmech.2011.02.071 BindingDB Entry DOI: 10.7270/Q2BK1CPG
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