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null
SMILES
ONC(=O)\C=C\c1csc(Br)n1
InChI Key
Tab Delimited (
TSV
)
2D SDfile
Computed 3D by
Vconf
-m prep SDfile
Find this compound or compounds like it in BindingDB:
GO
Substructure
Similarity at least:
must be >=0.5
Exact match
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found
7
hits for monomerid = 50588565
Target
Histone deacetylase
(Homo sapiens (Human))
TBA
Ligand
BDBM50588565
(CHEMBL5204550)
copy SMILES
Affinity Data
IC50: 3.23E+3nM
More data for this Ligand-Target Pair
Target Info
PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
Ligand Info
PC cid
PC sid
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2C53QTB
PubMed
Target
Histone deacetylase
(Homo sapiens (Human))
TBA
Ligand
BDBM50588565
(CHEMBL5204550)
copy SMILES
Affinity Data
IC50: 1.30E+3nM
More data for this Ligand-Target Pair
Target Info
PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
Ligand Info
PC cid
PC sid
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2C53QTB
PubMed
Target
Histone deacetylase 1
(Homo sapiens (Human))
TBA
Ligand
BDBM50588565
(CHEMBL5204550)
copy SMILES
Affinity Data
IC50: 1.50E+5nM
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
PC cid
PC sid
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2C53QTB
PubMed
Target
Histone deacetylase 8
(Homo sapiens (Human))
TBA
Ligand
BDBM50588565
(CHEMBL5204550)
copy SMILES
Affinity Data
IC50: 1.20E+3nM
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
PC cid
PC sid
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2C53QTB
PubMed
Target
Histone deacetylase 6
(Homo sapiens (Human))
TBA
Ligand
BDBM50588565
(CHEMBL5204550)
copy SMILES
Affinity Data
IC50: 170nM
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
PC cid
PC sid
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2C53QTB
PubMed
Target
Histone deacetylase 3
(Homo sapiens (Human))
TBA
Ligand
BDBM50588565
(CHEMBL5204550)
copy SMILES
Affinity Data
IC50: 1.50E+3nM
More data for this Ligand-Target Pair
Target Info
PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
PC cid
PC sid
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2C53QTB
PubMed
Target
Histone deacetylase 2
(Homo sapiens (Human))
TBA
Ligand
BDBM50588565
(CHEMBL5204550)
copy SMILES
Affinity Data
IC50: 330nM
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
PC cid
PC sid
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2C53QTB
PubMed