Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cholinesterase' and Ligand = 'BDBM50259605'   

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))	BDBM50259605 (CHEMBL4090150) Show SMILES Cc1c(C#N)c(=O)oc2cc(OCc3ccccc3Br)ccc12 Show InChI InChI=1S/C18H12BrNO3/c1-11-14-7-6-13(8-17(14)23-18(21)15(11)9-20)22-10-12-4-2-3-5-16(12)19/h2-8H,10H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of the Western Cape Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using S-butylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition measured after ...				Eur J Med Chem 125: 853-864 (2017) Article DOI: 10.1016/j.ejmech.2016.09.041 BindingDB Entry DOI: 10.7270/Q2BP057T
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