Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cholinesterase' and Ligand = 'BDBM50449397'   

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))	BDBM50449397 (CHEMBL3127041) Show SMILES CCNCc1cccc2oc3cc(OC)ccc3c12 Show InChI InChI=1S/C16H17NO2/c1-3-17-10-11-5-4-6-14-16(11)13-8-7-12(18-2)9-15(13)19-14/h4-9,17H,3,10H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.22E+4	n/a	n/a	n/a	n/a	n/a	n/a
Southeast University Curated by ChEMBL					Assay Description Inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 5 mins followed by substrate addition measured after 5 ...				Eur J Med Chem 76: 376-86 (2014) Article DOI: 10.1016/j.ejmech.2014.02.035 BindingDB Entry DOI: 10.7270/Q2W097FT
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