Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cholinesterase' and Ligand = 'BDBM50326252'   

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))	BDBM50326252 ((3aR,9bS)-1-methyl-1,2,3,3a,4,9b-hexahydrochromeno...) Show SMILES CNC(=O)Oc1ccc2[C@@H]3[C@@H](CCN3C)COc2c1 Show InChI InChI=1S/C14H18N2O3/c1-15-14(17)19-10-3-4-11-12(7-10)18-8-9-5-6-16(2)13(9)11/h3-4,7,9,13H,5-6,8H2,1-2H3,(H,15,17)/t9-,13-/m0/s1	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	3.55E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Inhibitory activity against butyrylcholinesterase (BChE) in human erythrocyte				J Med Chem 44: 105-9 (2001) BindingDB Entry DOI: 10.7270/Q2NG4RX2
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