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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 = 'BDBM50351944'   
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))
BDBM50351944
PNG
(CHEMBL1822043)
Show SMILES CC(C)CCc1c(O)c(CCC(=O)NO)ccc1OCCCCCCCC(=O)NO
Show InChI InChI=1S/C22H36N2O6/c1-16(2)9-12-18-19(13-10-17(22(18)27)11-14-21(26)24-29)30-15-7-5-3-4-6-8-20(25)23-28/h10,13,16,27-29H,3-9,11-12,14-15H2,1-2H3,(H,23,25)(H,24,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 280n/an/an/an/an/an/a



Taipei Medical University

Curated by ChEMBL


Assay Description
Inhibition of human HDAC8 using Boc-Lys(TFA)-AMC as substrate incubated 30 mins before substrate addition measured after 30 mins post substrate addit...


Eur J Med Chem 46: 4042-9 (2011)


Article DOI: 10.1016/j.ejmech.2011.06.002
BindingDB Entry DOI: 10.7270/Q2ZS2WWD
More data for this
Ligand-Target Pair