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BDBM50297159 2-(phenylamino)benzamide::CHEMBL561194

SMILES: NC(=O)c1ccccc1Nc1ccccc1

InChI Key: InChIKey=JKWQUMKCVDUICQ-UHFFFAOYSA-N

Data: 10 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 10 hits for monomerid = 50297159   
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))
BDBM50297159
PNG
(2-(phenylamino)benzamide | CHEMBL561194)
Show SMILES NC(=O)c1ccccc1Nc1ccccc1
Show InChI InChI=1S/C13H12N2O/c14-13(16)11-8-4-5-9-12(11)15-10-6-2-1-3-7-10/h1-9,15H,(H2,14,16)
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Article
PubMed
n/an/a 5.60E+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))
BDBM50297159
PNG
(2-(phenylamino)benzamide | CHEMBL561194)
Show SMILES NC(=O)c1ccccc1Nc1ccccc1
Show InChI InChI=1S/C13H12N2O/c14-13(16)11-8-4-5-9-12(11)15-10-6-2-1-3-7-10/h1-9,15H,(H2,14,16)
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PubMed
n/an/a 1.70E+4n/an/an/an/an/an/a



Sirtris, A GSK Company

Curated by ChEMBL


Assay Description
Inhibition of SIRT1


J Med Chem 54: 417-32 (2011)


Article DOI: 10.1021/jm100861p
BindingDB Entry DOI: 10.7270/Q25X2B28
More data for this
Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2


(Homo sapiens (Human))
BDBM50297159
PNG
(2-(phenylamino)benzamide | CHEMBL561194)
Show SMILES NC(=O)c1ccccc1Nc1ccccc1
Show InChI InChI=1S/C13H12N2O/c14-13(16)11-8-4-5-9-12(11)15-10-6-2-1-3-7-10/h1-9,15H,(H2,14,16)
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n/an/a 7.40E+4n/an/an/an/an/an/a



Guru Jambheshwar University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of SIRT2 (unknown origin) using acetylated lysine as substrate by Fluor de Lys assay


Eur J Med Chem 119: 45-69 (2016)


Article DOI: 10.1016/j.ejmech.2016.04.063
BindingDB Entry DOI: 10.7270/Q2VH5QTW
More data for this
Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1


(Homo sapiens (Human))
BDBM50297159
PNG
(2-(phenylamino)benzamide | CHEMBL561194)
Show SMILES NC(=O)c1ccccc1Nc1ccccc1
Show InChI InChI=1S/C13H12N2O/c14-13(16)11-8-4-5-9-12(11)15-10-6-2-1-3-7-10/h1-9,15H,(H2,14,16)
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PubMed
n/an/a 1.70E+4n/an/an/an/an/an/a



Guru Jambheshwar University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of SIRT1 (unknown origin) using acetylated lysine as substrate by Fluor de Lys assay


Eur J Med Chem 119: 45-69 (2016)


Article DOI: 10.1016/j.ejmech.2016.04.063
BindingDB Entry DOI: 10.7270/Q2VH5QTW
More data for this
Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-3, mitochondrial


(Homo sapiens (Human))
BDBM50297159
PNG
(2-(phenylamino)benzamide | CHEMBL561194)
Show SMILES NC(=O)c1ccccc1Nc1ccccc1
Show InChI InChI=1S/C13H12N2O/c14-13(16)11-8-4-5-9-12(11)15-10-6-2-1-3-7-10/h1-9,15H,(H2,14,16)
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PubMed
n/an/a 2.35E+5n/an/an/an/an/an/a



Sichuan University

Curated by ChEMBL


Assay Description
Inhibition of sirtuin 3 (unknown origin)


Eur J Med Chem 161: 48-77 (2019)

More data for this
Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2


(Homo sapiens (Human))
BDBM50297159
PNG
(2-(phenylamino)benzamide | CHEMBL561194)
Show SMILES NC(=O)c1ccccc1Nc1ccccc1
Show InChI InChI=1S/C13H12N2O/c14-13(16)11-8-4-5-9-12(11)15-10-6-2-1-3-7-10/h1-9,15H,(H2,14,16)
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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
NAD-dependent protein deacetylase sirtuin-1


(Homo sapiens (Human))
BDBM50297159
PNG
(2-(phenylamino)benzamide | CHEMBL561194)
Show SMILES NC(=O)c1ccccc1Nc1ccccc1
Show InChI InChI=1S/C13H12N2O/c14-13(16)11-8-4-5-9-12(11)15-10-6-2-1-3-7-10/h1-9,15H,(H2,14,16)
PDB

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UniChem

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Article
PubMed
n/an/a 5.60E+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-1


(Homo sapiens (Human))
BDBM50297159
PNG
(2-(phenylamino)benzamide | CHEMBL561194)
Show SMILES NC(=O)c1ccccc1Nc1ccccc1
Show InChI InChI=1S/C13H12N2O/c14-13(16)11-8-4-5-9-12(11)15-10-6-2-1-3-7-10/h1-9,15H,(H2,14,16)
PDB

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PubMed
n/an/a 1.70E+4n/an/an/an/an/an/a



Sichuan University

Curated by ChEMBL


Assay Description
Inhibition of sirtuin 1 (unknown origin)


Eur J Med Chem 161: 48-77 (2019)

More data for this
Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2


(Homo sapiens (Human))
BDBM50297159
PNG
(2-(phenylamino)benzamide | CHEMBL561194)
Show SMILES NC(=O)c1ccccc1Nc1ccccc1
Show InChI InChI=1S/C13H12N2O/c14-13(16)11-8-4-5-9-12(11)15-10-6-2-1-3-7-10/h1-9,15H,(H2,14,16)
PDB
MMDB

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KEGG

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antibodypedia
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CHEMBL
MCE
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PC sid
UniChem

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PubMed
n/an/a 7.40E+4n/an/an/an/an/an/a



Sichuan University

Curated by ChEMBL


Assay Description
Inhibition of sirtuin 2 (unknown origin)


Eur J Med Chem 161: 48-77 (2019)

More data for this
Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-3, mitochondrial


(Homo sapiens (Human))
BDBM50297159
PNG
(2-(phenylamino)benzamide | CHEMBL561194)
Show SMILES NC(=O)c1ccccc1Nc1ccccc1
Show InChI InChI=1S/C13H12N2O/c14-13(16)11-8-4-5-9-12(11)15-10-6-2-1-3-7-10/h1-9,15H,(H2,14,16)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 2.35E+5n/an/an/an/an/an/a



Guru Jambheshwar University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of SIRT3 (unknown origin) using acetylated lysine as substrate by Fluor de Lys assay


Eur J Med Chem 119: 45-69 (2016)


Article DOI: 10.1016/j.ejmech.2016.04.063
BindingDB Entry DOI: 10.7270/Q2VH5QTW
More data for this
Ligand-Target Pair