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Compile Data Set for Download or QSAR

Found 2 hits from Altana Pharma AG   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Histone deacetylase 1


(Homo sapiens (human))
BDBM50217137
PNG
(CHEMBL388710 | Ethyl 2-(4-Methylphenyl)-2-oxoethyl...)
Show SMILES CCSC(=S)SCC(=O)c1ccc(C)cc1
Show InChI InChI=1S/C12H14OS3/c1-3-15-12(14)16-8-11(13)10-6-4-9(2)5-7-10/h4-7H,3,8H2,1-2H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
7.00E+3n/an/an/an/an/an/an/an/a



Altana Pharma AG

Curated by ChEMBL


Assay Description
Inhibition of HDAC1 in HeLa cells


Bioorg Med Chem Lett 17: 4746-52 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.063
BindingDB Entry DOI: 10.7270/Q26H4H45
More data for this
Ligand-Target Pair
Histone deacetylase 3/NCoR1


(Homo sapiens (human))
BDBM50241188
PNG
(CHEMBL242039 | Ethyl 2-(4-Methoxyphenyl)-2-oxoethy...)
Show SMILES CCSC(=S)SCC(=O)c1ccc(OC)cc1
Show InChI InChI=1S/C12H14O2S3/c1-3-16-12(15)17-8-11(13)9-4-6-10(14-2)7-5-9/h4-7H,3,8H2,1-2H3
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 3.16E+3n/an/an/an/an/an/a



Altana Pharma AG

Curated by ChEMBL


Assay Description
Inhibition of HDAC3 in HeLa cells


Bioorg Med Chem Lett 17: 4746-52 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.063
BindingDB Entry DOI: 10.7270/Q26H4H45
More data for this
Ligand-Target Pair