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BDBM50187094 CHEMBL375409::N-(2-aminophenyl)-3-(6-(benzylamino)pyridin-3-yl)acrylamide

SMILES: Nc1ccccc1NC(=O)\C=C\c1ccc(NCc2ccccc2)nc1

InChI Key: InChIKey=OAAMYQXWVBCJOH-ACCUITESSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50187094   
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 1


(Homo sapiens (Human))
BDBM50187094
PNG
(CHEMBL375409 | N-(2-aminophenyl)-3-(6-(benzylamino...)
Show SMILES Nc1ccccc1NC(=O)\C=C\c1ccc(NCc2ccccc2)nc1
Show InChI InChI=1S/C21H20N4O/c22-18-8-4-5-9-19(18)25-21(26)13-11-17-10-12-20(24-15-17)23-14-16-6-2-1-3-7-16/h1-13,15H,14,22H2,(H,23,24)(H,25,26)/b13-11+
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
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AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 3.00E+3n/an/an/an/an/an/a



Menarini Ricerche

Curated by ChEMBL


Assay Description
Inhibition of HDAC1


J Med Chem 51: 1505-29 (2008)


Article DOI: 10.1021/jm7011408
BindingDB Entry DOI: 10.7270/Q2M32WMT
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50187094
PNG
(CHEMBL375409 | N-(2-aminophenyl)-3-(6-(benzylamino...)
Show SMILES Nc1ccccc1NC(=O)\C=C\c1ccc(NCc2ccccc2)nc1
Show InChI InChI=1S/C21H20N4O/c22-18-8-4-5-9-19(18)25-21(26)13-11-17-10-12-20(24-15-17)23-14-16-6-2-1-3-7-16/h1-13,15H,14,22H2,(H,23,24)(H,25,26)/b13-11+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 3.00E+3n/an/an/an/an/an/a



MethylGene Inc.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC1


Bioorg Med Chem Lett 16: 4048-52 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5
More data for this
Ligand-Target Pair