Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'NAD-dependent protein deacetylase sirtuin-2' and Ligand = 'BDBM50236565'   

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))	BDBM50236565 (CHEMBL4090249) Show SMILES CC(=O)OCCCc1nc(no1)-c1ccc(Cl)cc1 Show InChI InChI=1S/C13H13ClN2O3/c1-9(17)18-8-2-3-12-15-13(16-19-12)10-4-6-11(14)7-5-10/h4-7H,2-3,8H2,1H3	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.12E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bayreuth Curated by ChEMBL					Assay Description Inhibition of human N-terminal His6-SUMO-tagged SIRT2 catalytic domain (43 to 356 residues) deacetylase activity expressed in Escherichia coli using ...				J Med Chem 60: 2344-2360 (2017) Article DOI: 10.1021/acs.jmedchem.6b01609 BindingDB Entry DOI: 10.7270/Q2J968NS
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