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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone deacetylase' and Ligand = 'BDBM50478020'   
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


(Homo sapiens (Human))
BDBM50478020
PNG
(2-(Methylsulfonylthio)Ethyl 2-Propylpentanoate | C...)
Show SMILES CCCC(CCC)C(=O)OCCSS(C)(=O)=O
Show InChI InChI=1S/C11H22O4S2/c1-4-6-10(7-5-2)11(12)15-8-9-16-17(3,13)14/h10H,4-9H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 9.60E+3n/an/an/an/an/an/a



Sulfidris s.r.l.

Curated by ChEMBL


Assay Description
Inhibition of human HDAC in HeLa cells


Bioorg Med Chem Lett 18: 1893-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.007
BindingDB Entry DOI: 10.7270/Q2SJ1PCV
More data for this
Ligand-Target Pair