Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cholinesterase' and Ligand = 'BDBM50293447'   

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))	BDBM50293447 (CHEMBL549935 | N,N-diethyl-N-methyl-3-(7-oxo-7H-di...) Show SMILES CC[N+](C)(CC)CCCNC(=O)c1cnc2C(=O)c3ccccc3-c3cccc1c23 Show InChI InChI=1S/C25H27N3O2/c1-4-28(3,5-2)15-9-14-26-25(30)21-16-27-23-22-18(12-8-13-19(21)22)17-10-6-7-11-20(17)24(23)29/h6-8,10-13,16H,4-5,9,14-15H2,1-3H3/p+1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.72E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE by Ellman's method				Eur J Med Chem 44: 2523-32 (2009) Article DOI: 10.1016/j.ejmech.2009.01.021 BindingDB Entry DOI: 10.7270/Q2Z89CFV
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