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BDBM50139939 CHEMBL276707::N-Hydroxy-3-[1-methyl-4-(2-phenyl-cyclopropanecarbonyl)-1H-pyrrol-2-yl]-acrylamide

SMILES: Cn1cc(cc1C=CC(=O)NO)C(=O)C1CC1c1ccccc1

InChI Key: InChIKey=RLJXQVYXDDGCDN-UHFFFAOYSA-N

Data: 2 IC50

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

Found 2 hits for monomerid = 50139939   
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)
BDBM50139939
PNG
(CHEMBL276707 | N-Hydroxy-3-[1-methyl-4-(2-phenyl-c...)
Show SMILES Cn1cc(cc1C=CC(=O)NO)C(=O)C1CC1c1ccccc1 |w:7.8|
Show InChI InChI=1S/C18H18N2O3/c1-20-11-13(9-14(20)7-8-17(21)19-23)18(22)16-10-15(16)12-5-3-2-4-6-12/h2-9,11,15-16,23H,10H2,1H3,(H,19,21)
KEGG

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 310n/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 HD2


(Zea mays)
BDBM50139939
PNG
(CHEMBL276707 | N-Hydroxy-3-[1-methyl-4-(2-phenyl-c...)
Show SMILES Cn1cc(cc1C=CC(=O)NO)C(=O)C1CC1c1ccccc1 |w:7.8|
Show InChI InChI=1S/C18H18N2O3/c1-20-11-13(9-14(20)7-8-17(21)19-23)18(22)16-10-15(16)12-5-3-2-4-6-12/h2-9,11,15-16,23H,10H2,1H3,(H,19,21)
KEGG

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 309n/an/an/an/an/an/a



Università degli Studi di Roma La Sapienza

Curated by ChEMBL


Assay Description
Inhibitory concentration against histone deacetylase HD2 enzyme.


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