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Compile Data Set for Download or QSAR
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
(change energy unit to
kcal/mol
)
Found
5
hits in this display
Target
Bromodomain-containing protein 4
(Homo sapiens (Human))
Celgene Quanticel Research
Curated by
ChEMBL
Ligand
BDBM284968
(N-[3-(2-methyl-1-oxoisoquinolin-4-yl) phenyl]ethan...)
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Affinity Data
IC50: 160nM
Assay Description:
Inhibition of His-tagged human BRD4-BD1 using H4K5acK8acK12acK16ac as substrate preincubated for 30 mins followed by substrate addition measured afte...
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
Ligand Info
PC cid
PC sid
PDB
In Depth
Details
Article
PubMed
PDB
3D Structure (crystal)
Copy BDB DOI
Target
Bromodomain-containing protein 4
(Homo sapiens (Human))
Celgene Quanticel Research
Curated by
ChEMBL
Ligand
BDBM284968
(N-[3-(2-methyl-1-oxoisoquinolin-4-yl) phenyl]ethan...)
Copy SMILES
Copy InChI
Affinity Data
IC50: <500nM
pH: 7.3
Assay Description:
Determination of the IC50 for the heterocyclic derivative BRD4 inhibitors disclosed herein was performed as follows. His-tagged BRD4 was cloned, expr...
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
Ligand Info
PC cid
PC sid
PDB
In Depth
Details
US Patent
PDB
3D Structure (crystal)
Copy BDB DOI
Target
Bromodomain-containing protein 4
(Homo sapiens (Human))
Celgene Quanticel Research
Curated by
ChEMBL
Ligand
BDBM284968
(N-[3-(2-methyl-1-oxoisoquinolin-4-yl) phenyl]ethan...)
Copy SMILES
Copy InChI
Affinity Data
IC50: <500nM
Assay Description:
Determination of the IC50 for the heterocyclic derivative BRD4 inhibitors disclosed herein was performed as follows. His-tagged BRD4 was cloned, expr...
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
Ligand Info
PC cid
PC sid
PDB
In Depth
Details
US Patent
PDB
3D Structure (crystal)
Copy BDB DOI
Target
Bromodomain-containing protein 4
(Homo sapiens (Human))
Celgene Quanticel Research
Curated by
ChEMBL
Ligand
BDBM284968
(N-[3-(2-methyl-1-oxoisoquinolin-4-yl) phenyl]ethan...)
Copy SMILES
Copy InChI
Affinity Data
Kd: 82nM
Assay Description:
Inhibition of recombinant human BRD4-1 (44 to 168 residues) expressed in bacterial expression system by bromoscan assay
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
Ligand Info
PC cid
PC sid
PDB
In Depth
Details
PubMed
PDB
3D Structure (crystal)
Copy BDB DOI
Target
Bromodomain testis-specific protein
(Homo sapiens (Human))
University Of Minnesota
Curated by
ChEMBL
Ligand
BDBM284968
(N-[3-(2-methyl-1-oxoisoquinolin-4-yl) phenyl]ethan...)
Copy SMILES
Copy InChI
Affinity Data
Kd: 77nM
Assay Description:
Inhibition of recombinant human BRDT-1 (21 to 137 residues) expressed in bacterial expression system by bromoscan assay
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
Ligand Info
PC cid
PC sid
PDB
In Depth
Details
PubMed
PDB
3D Structure (crystal)
Copy BDB DOI