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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone deacetylase 1' and Ligand = 'BDBM50082268'   
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 1


(Homo sapiens (Human))
BDBM50082268
PNG
(CHEMBL3421753)
Show SMILES ONC(=O)c1ccc(CNCc2nc(no2)-c2ccc(F)cc2)cc1
Show InChI InChI=1S/C17H15FN4O3/c18-14-7-5-12(6-8-14)16-20-15(25-22-16)10-19-9-11-1-3-13(4-2-11)17(23)21-24/h1-8,19,24H,9-10H2,(H,21,23)
PDB
MMDB

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Reactome pathway
KEGG

UniProtKB/SwissProt

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GoogleScholar
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.53E+3n/an/an/an/an/an/a



Southeast University

Curated by ChEMBL


Assay Description
Inhibition of recombinant HDAC1 (unknown origin) using fluorogenic substrate Boc-Lys (acetyl)-AMC after 20 mins by homogeneous fluorescence release a...


Eur J Med Chem 96: 1-13 (2015)


Article DOI: 10.1016/j.ejmech.2015.04.002
BindingDB Entry DOI: 10.7270/Q21G0P01
More data for this
Ligand-Target Pair