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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
3
hits in this display
Target
Cytochrome P450 1B1
(Homo sapiens (Human))
Seoul National University
Curated by
ChEMBL
Ligand
BDBM50108044
(1-[(E)-2-(3,5-dimethoxyphenyl)vinyl]-2-fluoro-4-me...)
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Affinity Data
IC50: 97nM
Assay Description:
Inhibition of ethoxyresorufin O-deethylation (EROD) in bicistronic bacterial membranes expressing human cytochrome P450 1B1
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Cytochrome P450 1A1
(Homo sapiens (Human))
Seoul National University
Curated by
ChEMBL
Ligand
BDBM50108044
(1-[(E)-2-(3,5-dimethoxyphenyl)vinyl]-2-fluoro-4-me...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 610nM
Assay Description:
Inhibition of ethoxyresorufin O-deethylation (EROD) in bicistronic bacterial membranes epressing human cytochrome P450 1A1
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Cytochrome P450 1A2
(Homo sapiens (Human))
Seoul National University
Curated by
ChEMBL
Ligand
BDBM50108044
(1-[(E)-2-(3,5-dimethoxyphenyl)vinyl]-2-fluoro-4-me...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 5.80E+3nM
Assay Description:
Inhibition of ethoxyresorufin O-deethylation (EROD) in bicistronic bacterial membranes expressing human cytochrome P450 1A2
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
In Depth
Details
Article
PubMed
Copy BDB DOI