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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50346744   
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 6


(Homo sapiens (Human))
BDBM50346744
PNG
(CHEMBL1798008)
Show SMILES CC[C@H](C)[C@@H](CN1Cc2cc(OCC(=O)NO)ccc2C[C@H]1C(=O)Nc1ccc(OC)cc1)NC(=O)CC(C)(C)C |r|
Show InChI InChI=1S/C31H44N4O6/c1-7-20(2)26(33-28(36)16-31(3,4)5)18-35-17-22-14-25(41-19-29(37)34-39)11-8-21(22)15-27(35)30(38)32-23-9-12-24(40-6)13-10-23/h8-14,20,26-27,39H,7,15-19H2,1-6H3,(H,32,38)(H,33,36)(H,34,37)/t20-,26+,27-/m0/s1
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MMDB

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KEGG

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 158n/an/an/an/an/an/a



Shandong University

Curated by ChEMBL


Assay Description
Inhibition of HDAC6 in human HeLa cell nuclear extract after 30 mins by fluorescence microplate reader


J Med Chem 54: 2823-38 (2011)


Article DOI: 10.1021/jm101605z
BindingDB Entry DOI: 10.7270/Q2154HDR
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM50346744
PNG
(CHEMBL1798008)
Show SMILES CC[C@H](C)[C@@H](CN1Cc2cc(OCC(=O)NO)ccc2C[C@H]1C(=O)Nc1ccc(OC)cc1)NC(=O)CC(C)(C)C |r|
Show InChI InChI=1S/C31H44N4O6/c1-7-20(2)26(33-28(36)16-31(3,4)5)18-35-17-22-14-25(41-19-29(37)34-39)11-8-21(22)15-27(35)30(38)32-23-9-12-24(40-6)13-10-23/h8-14,20,26-27,39H,7,15-19H2,1-6H3,(H,32,38)(H,33,36)(H,34,37)/t20-,26+,27-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 333n/an/an/an/an/an/a



Shandong University

Curated by ChEMBL


Assay Description
Inhibition of HDAC8 after 30 mins by fluorescence microplate reader


J Med Chem 54: 2823-38 (2011)


Article DOI: 10.1021/jm101605z
BindingDB Entry DOI: 10.7270/Q2154HDR
More data for this
Ligand-Target Pair