Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'NAD-dependent protein deacetylase sirtuin-2' and Ligand = 'BDBM50199448'   

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
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50199448 (CD-03241 | CHEMBL386248) Show SMILES OCc1cccc(\C=N\c2cc(cc(c2)C(F)(F)F)\N=C\c2cccc(CO)c2O)c1O Show InChI InChI=1S/C23H19F3N2O4/c24-23(25,26)18-7-19(27-10-14-3-1-5-16(12-29)21(14)31)9-20(8-18)28-11-15-4-2-6-17(13-30)22(15)32/h1-11,29-32H,12-13H2/b27-10+,28-11+	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT2				J Med Chem 49: 7239-41 (2006) Article DOI: 10.1021/jm060686r BindingDB Entry DOI: 10.7270/Q2WM1D24
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