Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'NAD-dependent protein deacetylase sirtuin-2' and Ligand = 'BDBM50197511'   

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))	BDBM50197511 (CHEMBL3935689) Show SMILES CC(=S)NCCCC[C@@H]1NC(=O)CNCCC(=O)NCCCC[C@H](NC1=O)C(N)=O |r| Show InChI InChI=1S/C19H34N6O4S/c1-13(30)22-9-4-3-7-15-19(29)25-14(18(20)28)6-2-5-10-23-16(26)8-11-21-12-17(27)24-15/h14-15,21H,2-12H2,1H3,(H2,20,28)(H,22,30)(H,23,26)(H,24,27)(H,25,29)/t14-,15-/m0/s1	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.43E+4	n/a	n/a	n/a	n/a	n/a	n/a
Jiangsu University Curated by ChEMBL					Assay Description Inhibition of recombinant human His6-tagged SIRT2 using H2N-HK-[Nepsilon-acetyl-lysine]-LM-COOH as substrate incubated for 12 mins in presence of bet...				Bioorg Med Chem Lett 26: 5234-5239 (2016) Article DOI: 10.1016/j.bmcl.2016.09.055 BindingDB Entry DOI: 10.7270/Q20R9RCN
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