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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'NAD-dependent protein deacetylase sirtuin-2' and Ligand = 'BDBM50156759'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
NAD-dependent protein deacetylase sirtuin-2


(Homo sapiens (Human))
BDBM50156759
PNG
(5-((2-(3,5-dichloro-2-hydroxybenzylideneamino)phen...)
Show SMILES Cc1ncc(CSc2ccccc2\N=C\c2cc(Cl)cc(Cl)c2O)c(CO)c1O
Show InChI InChI=1S/C21H18Cl2N2O3S/c1-12-20(27)16(10-26)14(9-24-12)11-29-19-5-3-2-4-18(19)25-8-13-6-15(22)7-17(23)21(13)28/h2-9,26-28H,10-11H2,1H3/b25-8+
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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 7.40E+4n/an/an/an/an/an/a



Martin-Luther University of Halle-Wittenberg

Curated by ChEMBL


Assay Description
Inhibition of Sirt2


Bioorg Med Chem 19: 3605-15 (2011)


Article DOI: 10.1016/j.bmc.2011.01.029
BindingDB Entry DOI: 10.7270/Q2SN0992
More data for this
Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2


(Homo sapiens (Human))
BDBM50156759
PNG
(5-((2-(3,5-dichloro-2-hydroxybenzylideneamino)phen...)
Show SMILES Cc1ncc(CSc2ccccc2\N=C\c2cc(Cl)cc(Cl)c2O)c(CO)c1O
Show InChI InChI=1S/C21H18Cl2N2O3S/c1-12-20(27)16(10-26)14(9-24-12)11-29-19-5-3-2-4-18(19)25-8-13-6-15(22)7-17(23)21(13)28/h2-9,26-28H,10-11H2,1H3/b25-8+
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 7.43E+4n/an/an/an/an/an/a



University of Kuopio

Curated by ChEMBL


Assay Description
Inhibition of SIRT2


J Med Chem 49: 7907-11 (2006)


Article DOI: 10.1021/jm060566j
BindingDB Entry DOI: 10.7270/Q2G73FHM
More data for this
Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2


(Homo sapiens (Human))
BDBM50156759
PNG
(5-((2-(3,5-dichloro-2-hydroxybenzylideneamino)phen...)
Show SMILES Cc1ncc(CSc2ccccc2\N=C\c2cc(Cl)cc(Cl)c2O)c(CO)c1O
Show InChI InChI=1S/C21H18Cl2N2O3S/c1-12-20(27)16(10-26)14(9-24-12)11-29-19-5-3-2-4-18(19)25-8-13-6-15(22)7-17(23)21(13)28/h2-9,26-28H,10-11H2,1H3/b25-8+
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 7.43E+4n/an/an/an/an/an/a



University of Kuopio

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-tagged SIRT2 by histone deacetylase assay


J Med Chem 47: 6292-8 (2004)


Article DOI: 10.1021/jm049933m
BindingDB Entry DOI: 10.7270/Q2S1820Z
More data for this
Ligand-Target Pair