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BDBM50297166 2-(3-Hydroxymethylphenylamino)benzamide::CHEMBL561596

SMILES: NC(=O)c1ccccc1Nc1cccc(CO)c1

InChI Key: InChIKey=AUSGHKHOFYDADP-UHFFFAOYSA-N

Data: 3 IC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50297166   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
NAD-dependent protein deacetylase sirtuin-1


(Homo sapiens (Human))
BDBM50297166
PNG
(2-(3-Hydroxymethylphenylamino)benzamide | CHEMBL56...)
Show SMILES NC(=O)c1ccccc1Nc1cccc(CO)c1
Show InChI InChI=1S/C14H14N2O2/c15-14(18)12-6-1-2-7-13(12)16-11-5-3-4-10(8-11)9-17/h1-8,16-17H,9H2,(H2,15,18)
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CHEMBL
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PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.00E+4n/an/an/an/an/an/a



Nagoya City University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant SIRT1 by fluorimetric analysis


Bioorg Med Chem 17: 5900-5 (2009)


Article DOI: 10.1016/j.bmc.2009.07.001
BindingDB Entry DOI: 10.7270/Q24X57TQ
More data for this
Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1


(Homo sapiens (Human))
BDBM50297166
PNG
(2-(3-Hydroxymethylphenylamino)benzamide | CHEMBL56...)
Show SMILES NC(=O)c1ccccc1Nc1cccc(CO)c1
Show InChI InChI=1S/C14H14N2O2/c15-14(18)12-6-1-2-7-13(12)16-11-5-3-4-10(8-11)9-17/h1-8,16-17H,9H2,(H2,15,18)
PDB

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antibodypedia
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UniChem

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Article
PubMed
n/an/a 6.00E+4n/an/an/an/an/an/a



Kyoto Prefectural University of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human recombinant SIRT1 using Fluor de Lys-SIRT as substrate incubated for 60 mins prior to substrate addition measured after 60 mins b...


J Med Chem 55: 5760-73 (2012)


Article DOI: 10.1021/jm3002108
BindingDB Entry DOI: 10.7270/Q2WW7JRS
More data for this
Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2


(Homo sapiens (Human))
BDBM50297166
PNG
(2-(3-Hydroxymethylphenylamino)benzamide | CHEMBL56...)
Show SMILES NC(=O)c1ccccc1Nc1cccc(CO)c1
Show InChI InChI=1S/C14H14N2O2/c15-14(18)12-6-1-2-7-13(12)16-11-5-3-4-10(8-11)9-17/h1-8,16-17H,9H2,(H2,15,18)
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Kyoto Prefectural University of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human recombinant SIRT2 using Fluor de Lys-SIRT as substrate incubated for 60 mins prior to substrate addition measured after 60 mins b...


J Med Chem 55: 5760-73 (2012)


Article DOI: 10.1021/jm3002108
BindingDB Entry DOI: 10.7270/Q2WW7JRS
More data for this
Ligand-Target Pair