Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cholinesterase' and Ligand = 'BDBM50076632'   

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))	BDBM50076632 ((8aS,10aS)-6-(tert-Butyl-dimethyl-silanyloxy)-8-me...) Show SMILES COC1C=C(C[C@@H]2Oc3ccccc3C(=O)[C@]12C#N)O[Si](C)(C)C(C)(C)C |c:3| Show InChI InChI=1S/C21H27NO4Si/c1-20(2,3)27(5,6)26-14-11-17(24-4)21(13-22)18(12-14)25-16-10-8-7-9-15(16)19(21)23/h7-11,17-18H,12H2,1-6H3/t17?,18-,21+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	350	n/a	n/a	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description In vitro inhibitory activity against Butyrylcholinesterase				Bioorg Med Chem Lett 9: 973-8 (1999) BindingDB Entry DOI: 10.7270/Q22V2F91
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