Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cholinesterase' and Ligand = 'BDBM50241978'   

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))	BDBM50241978 (CHEMBL4093928) Show SMILES CCO[P@@](=O)(SCC)c1ccccc1 |r| Show InChI InChI=1S/C10H15O2PS/c1-3-12-13(11,14-4-2)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3/t13-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Missouri St. Louis Curated by ChEMBL					Assay Description Inhibition of horse BChE using butyrylthiocholine iodide as substrate measured for 30 secs by Ellman's method				Bioorg Med Chem 25: 3053-3058 (2017) Article DOI: 10.1016/j.bmc.2017.03.058 BindingDB Entry DOI: 10.7270/Q2H70J09
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