Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'NAD-dependent protein deacetylase sirtuin-2' and Ligand = 'BDBM50523795'   

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))	BDBM50523795 (CHEMBL4551537) Show SMILES CCN(CC)c1ccnc(CN[C@@H](Cc2cn(cn2)C(c2ccccc2)(c2ccccc2)c2ccccc2)C(=O)OC)c1 |r| Show InChI InChI=1S/C36H39N5O2/c1-4-40(5-2)33-21-22-37-31(23-33)25-38-34(35(42)43-3)24-32-26-41(27-39-32)36(28-15-9-6-10-16-28,29-17-11-7-12-18-29)30-19-13-8-14-20-30/h6-23,26-27,34,38H,4-5,24-25H2,1-3H3/t34-/m0/s1	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kumamoto University Curated by ChEMBL					Assay Description Inhibition of recombinant SIRT2 (unknown origin) using FAM-RHKK(Ac)LM as substrate measured after 60 mins by electrophoretic mobility shift assay				Bioorg Med Chem 27: 1767-1775 (2019) Article DOI: 10.1016/j.bmc.2019.03.003 BindingDB Entry DOI: 10.7270/Q28P63Z2
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