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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Histone deacetylase 2b' and Ligand = 'BDBM50139948'   
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
Histone deacetylase 2b


(Zea mays)
BDBM50139948
PNG
((E)-5-[1-Methyl-4-(3-phenyl-acryloyl)-1H-pyrrol-2-...)
Show SMILES Cn1cc(cc1\C=C\C=C\C(=O)NO)C(=O)\C=C\c1ccccc1
Show InChI InChI=1S/C19H18N2O3/c1-21-14-16(13-17(21)9-5-6-10-19(23)20-24)18(22)12-11-15-7-3-2-4-8-15/h2-14,24H,1H3,(H,20,23)/b9-5+,10-6+,12-11+
KEGG

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 9.90E+3n/an/an/an/an/an/a



Università degli Studi di Roma La Sapienza

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase 2b


(Zea mays)
BDBM50139948
PNG
((E)-5-[1-Methyl-4-(3-phenyl-acryloyl)-1H-pyrrol-2-...)
Show SMILES Cn1cc(cc1\C=C\C=C\C(=O)NO)C(=O)\C=C\c1ccccc1
Show InChI InChI=1S/C19H18N2O3/c1-21-14-16(13-17(21)9-5-6-10-19(23)20-24)18(22)12-11-15-7-3-2-4-8-15/h2-14,24H,1H3,(H,20,23)/b9-5+,10-6+,12-11+
KEGG

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.00E+4n/an/an/an/an/an/a



Università degli Studi di Roma La Sapienza

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair