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BDBM50082657 4-Dimethylamino-N-(7-hydroxycarbamoyl-heptyl)-benzamide::CHEMBL143047

SMILES: CN(C)c1ccc(cc1)C(=O)NCCCCCCCC(=O)NO

InChI Key: InChIKey=NMUMGBKBHOJAQD-UHFFFAOYSA-N

Data: 7 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 7 hits for monomerid = 50082657   
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 HD2


(Zea mays)
BDBM50082657
PNG
(4-Dimethylamino-N-(7-hydroxycarbamoyl-heptyl)-benz...)
Show SMILES CN(C)c1ccc(cc1)C(=O)NCCCCCCCC(=O)NO
Show InChI InChI=1S/C17H27N3O3/c1-20(2)15-11-9-14(10-12-15)17(22)18-13-7-5-3-4-6-8-16(21)19-23/h9-12,23H,3-8,13H2,1-2H3,(H,18,22)(H,19,21)
KEGG

UniProtKB/TrEMBL

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 300n/an/an/an/an/an/a



Westfälische Wilhelms-Universität Münster

Curated by ChEMBL


Assay Description
Inhibition of maize Histone deacetylase 2 (HD-2) activity


J Med Chem 42: 4669-79 (1999)


Article DOI: 10.1021/jm991091h
BindingDB Entry DOI: 10.7270/Q2PC31M7
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50082657
PNG
(4-Dimethylamino-N-(7-hydroxycarbamoyl-heptyl)-benz...)
Show SMILES CN(C)c1ccc(cc1)C(=O)NCCCCCCCC(=O)NO
Show InChI InChI=1S/C17H27N3O3/c1-20(2)15-11-9-14(10-12-15)17(22)18-13-7-5-3-4-6-8-16(21)19-23/h9-12,23H,3-8,13H2,1-2H3,(H,18,22)(H,19,21)
KEGG

UniProtKB/TrEMBL

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 300n/an/an/an/an/an/a



Aton Pharma, Inc

Curated by ChEMBL


Assay Description
Inhibitory concentration against maize Histone deacetylase 2


J Med Chem 46: 5097-116 (2003)


Article DOI: 10.1021/jm0303094
BindingDB Entry DOI: 10.7270/Q2MP5413
More data for this
Ligand-Target Pair
Histone deacetylase


(Homo sapiens (Human))
BDBM50082657
PNG
(4-Dimethylamino-N-(7-hydroxycarbamoyl-heptyl)-benz...)
Show SMILES CN(C)c1ccc(cc1)C(=O)NCCCCCCCC(=O)NO
Show InChI InChI=1S/C17H27N3O3/c1-20(2)15-11-9-14(10-12-15)17(22)18-13-7-5-3-4-6-8-16(21)19-23/h9-12,23H,3-8,13H2,1-2H3,(H,18,22)(H,19,21)
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n/an/a 2.18E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Concentration required to inhibit the partially purified HDAC enzyme by 50% obtained from H1299 cell lysate


J Med Chem 45: 753-7 (2002)


BindingDB Entry DOI: 10.7270/Q2T156D5
More data for this
Ligand-Target Pair
Hdac5 protein


(Rattus norvegicus)
BDBM50082657
PNG
(4-Dimethylamino-N-(7-hydroxycarbamoyl-heptyl)-benz...)
Show SMILES CN(C)c1ccc(cc1)C(=O)NCCCCCCCC(=O)NO
Show InChI InChI=1S/C17H27N3O3/c1-20(2)15-11-9-14(10-12-15)17(22)18-13-7-5-3-4-6-8-16(21)19-23/h9-12,23H,3-8,13H2,1-2H3,(H,18,22)(H,19,21)
UniProtKB/TrEMBL

GoogleScholar
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PC cid
PC sid
UniChem

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PubMed
n/an/a 241n/an/an/an/an/an/a



Westf£lische Wilhelms-Universit£t M£nster

Curated by ChEMBL


Assay Description
Inhibitory activity against rat liver Histone deacetylase with substrate 5b


J Med Chem 47: 5235-43 (2004)


BindingDB Entry DOI: 10.7270/Q2086839
More data for this
Ligand-Target Pair
Hdac5 protein


(Rattus norvegicus)
BDBM50082657
PNG
(4-Dimethylamino-N-(7-hydroxycarbamoyl-heptyl)-benz...)
Show SMILES CN(C)c1ccc(cc1)C(=O)NCCCCCCCC(=O)NO
Show InChI InChI=1S/C17H27N3O3/c1-20(2)15-11-9-14(10-12-15)17(22)18-13-7-5-3-4-6-8-16(21)19-23/h9-12,23H,3-8,13H2,1-2H3,(H,18,22)(H,19,21)
UniProtKB/TrEMBL

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 256n/an/an/an/an/an/a



Westf£lische Wilhelms-Universit£t M£nster

Curated by ChEMBL


Assay Description
Inhibitory activity against rat liver Histone deacetylase with substrate 3a


J Med Chem 47: 5235-43 (2004)


BindingDB Entry DOI: 10.7270/Q2086839
More data for this
Ligand-Target Pair
Hdac5 protein


(Rattus norvegicus)
BDBM50082657
PNG
(4-Dimethylamino-N-(7-hydroxycarbamoyl-heptyl)-benz...)
Show SMILES CN(C)c1ccc(cc1)C(=O)NCCCCCCCC(=O)NO
Show InChI InChI=1S/C17H27N3O3/c1-20(2)15-11-9-14(10-12-15)17(22)18-13-7-5-3-4-6-8-16(21)19-23/h9-12,23H,3-8,13H2,1-2H3,(H,18,22)(H,19,21)
UniProtKB/TrEMBL

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 488n/an/an/an/an/an/a



Westf£lische Wilhelms-Universit£t M£nster

Curated by ChEMBL


Assay Description
Inhibitory activity against rat liver Histone deacetylase with substrate 3b


J Med Chem 47: 5235-43 (2004)


BindingDB Entry DOI: 10.7270/Q2086839
More data for this
Ligand-Target Pair
Histone deacetylase


(Homo sapiens (Human))
BDBM50082657
PNG
(4-Dimethylamino-N-(7-hydroxycarbamoyl-heptyl)-benz...)
Show SMILES CN(C)c1ccc(cc1)C(=O)NCCCCCCCC(=O)NO
Show InChI InChI=1S/C17H27N3O3/c1-20(2)15-11-9-14(10-12-15)17(22)18-13-7-5-3-4-6-8-16(21)19-23/h9-12,23H,3-8,13H2,1-2H3,(H,18,22)(H,19,21)
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PubMed
n/an/a 145n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Concentration required to inhibit human Histone deacetylase (HDAC) enzyme by 50%


J Med Chem 45: 753-7 (2002)


BindingDB Entry DOI: 10.7270/Q2T156D5
More data for this
Ligand-Target Pair