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BDBM50232046 CHEMBL405072::N-(2-aminophenyl)benzamide

SMILES: Nc1ccccc1NC(=O)c1ccccc1

InChI Key: InChIKey=RFDVMOUXHKTCDO-UHFFFAOYSA-N

Data: 11 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 11 hits for monomerid = 50232046   
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
Histone deacetylase 2


(Homo sapiens (Human))
BDBM50232046
PNG
(CHEMBL405072 | N-(2-aminophenyl)benzamide)
Show SMILES Nc1ccccc1NC(=O)c1ccccc1
Show InChI InChI=1S/C13H12N2O/c14-11-8-4-5-9-12(11)15-13(16)10-6-2-1-3-7-10/h1-9H,14H2,(H,15,16)
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PubMed
n/an/a 3.10E+3n/an/an/an/an/an/a



Takeda San Diego

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC2 preincubated for 24 hrs followed by 1 hr reaction with substrate by protease coupled end-point assay


Bioorg Med Chem Lett 20: 3142-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.091
BindingDB Entry DOI: 10.7270/Q2HX1CT8
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM50232046
PNG
(CHEMBL405072 | N-(2-aminophenyl)benzamide)
Show SMILES Nc1ccccc1NC(=O)c1ccccc1
Show InChI InChI=1S/C13H12N2O/c14-11-8-4-5-9-12(11)15-13(16)10-6-2-1-3-7-10/h1-9H,14H2,(H,15,16)
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n/an/a 1.00E+4n/an/an/an/an/an/a



Takeda San Diego

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC2 preincubated for 1 hr with substrate by protease coupled end-point assay


Bioorg Med Chem Lett 20: 3142-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.091
BindingDB Entry DOI: 10.7270/Q2HX1CT8
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM50232046
PNG
(CHEMBL405072 | N-(2-aminophenyl)benzamide)
Show SMILES Nc1ccccc1NC(=O)c1ccccc1
Show InChI InChI=1S/C13H12N2O/c14-11-8-4-5-9-12(11)15-13(16)10-6-2-1-3-7-10/h1-9H,14H2,(H,15,16)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of HDAC8


Bioorg Med Chem Lett 18: 973-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.031
BindingDB Entry DOI: 10.7270/Q2765G5S
More data for this
Ligand-Target Pair
Histone deacetylase 11


(Homo sapiens (Human))
BDBM50232046
PNG
(CHEMBL405072 | N-(2-aminophenyl)benzamide)
Show SMILES Nc1ccccc1NC(=O)c1ccccc1
Show InChI InChI=1S/C13H12N2O/c14-11-8-4-5-9-12(11)15-13(16)10-6-2-1-3-7-10/h1-9H,14H2,(H,15,16)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of HDAC11


Bioorg Med Chem Lett 18: 973-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.031
BindingDB Entry DOI: 10.7270/Q2765G5S
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM50232046
PNG
(CHEMBL405072 | N-(2-aminophenyl)benzamide)
Show SMILES Nc1ccccc1NC(=O)c1ccccc1
Show InChI InChI=1S/C13H12N2O/c14-11-8-4-5-9-12(11)15-13(16)10-6-2-1-3-7-10/h1-9H,14H2,(H,15,16)
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n/an/a 3.30E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of HDAC2


Bioorg Med Chem Lett 18: 973-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.031
BindingDB Entry DOI: 10.7270/Q2765G5S
More data for this
Ligand-Target Pair
Histone deacetylase 7


(Homo sapiens (Human))
BDBM50232046
PNG
(CHEMBL405072 | N-(2-aminophenyl)benzamide)
Show SMILES Nc1ccccc1NC(=O)c1ccccc1
Show InChI InChI=1S/C13H12N2O/c14-11-8-4-5-9-12(11)15-13(16)10-6-2-1-3-7-10/h1-9H,14H2,(H,15,16)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of HDAC7


Bioorg Med Chem Lett 18: 973-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.031
BindingDB Entry DOI: 10.7270/Q2765G5S
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50232046
PNG
(CHEMBL405072 | N-(2-aminophenyl)benzamide)
Show SMILES Nc1ccccc1NC(=O)c1ccccc1
Show InChI InChI=1S/C13H12N2O/c14-11-8-4-5-9-12(11)15-13(16)10-6-2-1-3-7-10/h1-9H,14H2,(H,15,16)
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n/an/a 2.40E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of HDAC1


Bioorg Med Chem Lett 18: 973-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.031
BindingDB Entry DOI: 10.7270/Q2765G5S
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50232046
PNG
(CHEMBL405072 | N-(2-aminophenyl)benzamide)
Show SMILES Nc1ccccc1NC(=O)c1ccccc1
Show InChI InChI=1S/C13H12N2O/c14-11-8-4-5-9-12(11)15-13(16)10-6-2-1-3-7-10/h1-9H,14H2,(H,15,16)
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n/an/a 2.80E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of HDAC3


Bioorg Med Chem Lett 18: 973-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.031
BindingDB Entry DOI: 10.7270/Q2765G5S
More data for this
Ligand-Target Pair
Histone deacetylase 4


(Homo sapiens (Human))
BDBM50232046
PNG
(CHEMBL405072 | N-(2-aminophenyl)benzamide)
Show SMILES Nc1ccccc1NC(=O)c1ccccc1
Show InChI InChI=1S/C13H12N2O/c14-11-8-4-5-9-12(11)15-13(16)10-6-2-1-3-7-10/h1-9H,14H2,(H,15,16)
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PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of HDAC4


Bioorg Med Chem Lett 18: 973-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.031
BindingDB Entry DOI: 10.7270/Q2765G5S
More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM50232046
PNG
(CHEMBL405072 | N-(2-aminophenyl)benzamide)
Show SMILES Nc1ccccc1NC(=O)c1ccccc1
Show InChI InChI=1S/C13H12N2O/c14-11-8-4-5-9-12(11)15-13(16)10-6-2-1-3-7-10/h1-9H,14H2,(H,15,16)
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Article
PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of HDAC6


Bioorg Med Chem Lett 18: 973-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.031
BindingDB Entry DOI: 10.7270/Q2765G5S
More data for this
Ligand-Target Pair
Histone deacetylase 5


(Homo sapiens (Human))
BDBM50232046
PNG
(CHEMBL405072 | N-(2-aminophenyl)benzamide)
Show SMILES Nc1ccccc1NC(=O)c1ccccc1
Show InChI InChI=1S/C13H12N2O/c14-11-8-4-5-9-12(11)15-13(16)10-6-2-1-3-7-10/h1-9H,14H2,(H,15,16)
KEGG

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Article
PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of HDAC5


Bioorg Med Chem Lett 18: 973-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.031
BindingDB Entry DOI: 10.7270/Q2765G5S
More data for this
Ligand-Target Pair