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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone deacetylase 1/2/3/4/5/6/7/8/9/11/Polyamine deacetylase HDAC10' and Ligand = 'BDBM50221740'   
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 1/2/3/4/5/6/7/8/9/11/Polyamine deacetylase HDAC10


(Mus musculus-Mus musculus (Mouse))
BDBM50221740
PNG
(CHEMBL1790598)
Show SMILES [H][C@@]12CCCCN1C(=O)[C@@]([H])(NC(=O)[C@@H](Cc1ccc(OC)cc1)NC(=O)[C@H](CCCCCCN(O)C=O)NC2=O)[C@H](C)CC
Show InChI InChI=1S/C31H47N5O7/c1-4-21(2)27-31(41)36-18-10-8-12-26(36)30(40)32-24(11-7-5-6-9-17-35(42)20-37)28(38)33-25(29(39)34-27)19-22-13-15-23(43-3)16-14-22/h13-16,20-21,24-27,42H,4-12,17-19H2,1-3H3,(H,32,40)(H,33,38)(H,34,39)/t21-,24+,25-,26+,27+/m1/s1
PDB
MMDB

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Similars

Article
PubMed
n/an/a 1.35E+3n/an/an/an/an/an/a



Institute of Technology

Curated by ChEMBL


Assay Description
Inhibitory activity against histone deacetylases (HDAC) prepared from mouse melanoma B16/BL6 cells


Bioorg Med Chem Lett 14: 2427-31 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.018
BindingDB Entry DOI: 10.7270/Q20V8DC5
More data for this
Ligand-Target Pair