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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50522944   
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))
BDBM50522944
PNG
(CHEMBL4542710)
Show SMILES ONC(=O)CCc1csc(\C=C\c2c[nH]c3ccccc23)n1
Show InChI InChI=1S/C16H15N3O2S/c20-15(19-21)7-6-12-10-22-16(18-12)8-5-11-9-17-14-4-2-1-3-13(11)14/h1-5,8-10,17,21H,6-7H2,(H,19,20)/b8-5+
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 117n/an/an/an/an/an/a



Sungkyunkwan University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC6 using fluorogenic HDAC substrate 3 pre-incubated for 30 mins followed by HDAC developer addition and measured a...


Bioorg Med Chem 27: 3408-3420 (2019)


Article DOI: 10.1016/j.bmc.2019.06.036
BindingDB Entry DOI: 10.7270/Q2CR5XRJ
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50522944
PNG
(CHEMBL4542710)
Show SMILES ONC(=O)CCc1csc(\C=C\c2c[nH]c3ccccc23)n1
Show InChI InChI=1S/C16H15N3O2S/c20-15(19-21)7-6-12-10-22-16(18-12)8-5-11-9-17-14-4-2-1-3-13(11)14/h1-5,8-10,17,21H,6-7H2,(H,19,20)/b8-5+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 395n/an/an/an/an/an/a



Sungkyunkwan University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC1 using fluorogenic HDAC substrate 3 pre-incubated for 30 mins followed by HDAC developer addition and measured a...


Bioorg Med Chem 27: 3408-3420 (2019)


Article DOI: 10.1016/j.bmc.2019.06.036
BindingDB Entry DOI: 10.7270/Q2CR5XRJ
More data for this
Ligand-Target Pair