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SMILES: CCSC(=S)SCC(=O)c1cccc(c1)C(=O)NCCOc1ccccc1

InChI Key: InChIKey=PYDLUHVKGIBZLZ-UHFFFAOYSA-N

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50252107   
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))
BDBM50252107
PNG
(CHEMBL482272 | Ethyl 2-oxo-2-[3-(2-phenoxy-ethylca...)
Show SMILES CCSC(=S)SCC(=O)c1cccc(c1)C(=O)NCCOc1ccccc1
Show InChI InChI=1S/C20H21NO3S3/c1-2-26-20(25)27-14-18(22)15-7-6-8-16(13-15)19(23)21-11-12-24-17-9-4-3-5-10-17/h3-10,13H,2,11-12,14H2,1H3,(H,21,23)
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 328n/an/an/an/an/an/a



Nycomed GmbH

Curated by ChEMBL


Assay Description
Inhibition of recombinant HDAC1 (unknown origin) expressed in HEK293 cells


J Med Chem 51: 3985-4001 (2008)


Article DOI: 10.1021/jm800093c
BindingDB Entry DOI: 10.7270/Q29886S0
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50252107
PNG
(CHEMBL482272 | Ethyl 2-oxo-2-[3-(2-phenoxy-ethylca...)
Show SMILES CCSC(=S)SCC(=O)c1cccc(c1)C(=O)NCCOc1ccccc1
Show InChI InChI=1S/C20H21NO3S3/c1-2-26-20(25)27-14-18(22)15-7-6-8-16(13-15)19(23)21-11-12-24-17-9-4-3-5-10-17/h3-10,13H,2,11-12,14H2,1H3,(H,21,23)
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 198n/an/an/an/an/an/a



Nycomed GmbH

Curated by ChEMBL


Assay Description
Inhibition of recombinant HDAC6 (unknown origin) expressed in HEK293 cells


J Med Chem 51: 3985-4001 (2008)


Article DOI: 10.1021/jm800093c
BindingDB Entry DOI: 10.7270/Q29886S0
More data for this
Ligand-Target Pair