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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone deacetylase 9' and Ligand = 'BDBM50516203'   
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 9


(Homo sapiens (Human))
BDBM50516203
PNG
(CHEMBL4517151)
Show SMILES CN(Cc1nc(no1)C1CCN(Cc2ccc(C)cc2)CC1)c1ncc(cn1)C(=O)NO
Show InChI InChI=1S/C22H27N7O3/c1-15-3-5-16(6-4-15)13-29-9-7-17(8-10-29)20-25-19(32-27-20)14-28(2)22-23-11-18(12-24-22)21(30)26-31/h3-6,11-12,17,31H,7-10,13-14H2,1-2H3,(H,26,30)
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 441n/an/an/an/an/an/a



Sichuan University and Collaborative Innovation Center of Biotherapy

Curated by ChEMBL


Assay Description
Inhibition of recombinant C-terminal His-tagged human HDAC9 (604 to 1066 residues) expressed in baculovirus infected Sf9 cells using Ac-peptide-AMC a...


Eur J Med Chem 178: 116-130 (2019)


Article DOI: 10.1016/j.ejmech.2019.05.089
BindingDB Entry DOI: 10.7270/Q2HM5CTP
More data for this
Ligand-Target Pair