Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cholinesterase' and Ligand = 'BDBM50102729'   

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 (Homo sapiens (Human))	BDBM50102729 (CHEMBL1204296 | CHEMBL90264 | N-(2-(1-benzylpiperi...) Show SMILES CCc1cc(NCCC2CCN(Cc3ccccc3)CC2)nnc1-c1ccccc1 Show InChI InChI=1S/C26H32N4/c1-2-23-19-25(28-29-26(23)24-11-7-4-8-12-24)27-16-13-21-14-17-30(18-15-21)20-22-9-5-3-6-10-22/h3-12,19,21H,2,13-18,20H2,1H3,(H,27,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	920	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of butyrylcholinesterase from human serum				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
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