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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone deacetylase 8' and Ligand = 'BDBM50391635'   
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 8


(Homo sapiens (Human))
BDBM50391635
PNG
(CHEMBL2147947)
Show SMILES OC(=O)[C@H](Cc1ccc(OCCc2ccccc2)cc1)NC(=O)c1ccccc1 |r|
Show InChI InChI=1S/C24H23NO4/c26-23(20-9-5-2-6-10-20)25-22(24(27)28)17-19-11-13-21(14-12-19)29-16-15-18-7-3-1-4-8-18/h1-14,22H,15-17H2,(H,25,26)(H,27,28)/t22-/m0/s1
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PC cid
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Similars

Article
PubMed
n/an/a 2.53E+5n/an/an/an/an/an/a



Tianjin Medical University

Curated by ChEMBL


Assay Description
Inhibition of HDAC8 after 45 mins by microplate fluorometric analysis


Bioorg Med Chem 20: 5738-44 (2012)


Article DOI: 10.1016/j.bmc.2012.08.014
BindingDB Entry DOI: 10.7270/Q2988849
More data for this
Ligand-Target Pair