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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
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Target
Glutaminyl-peptide cyclotransferase
(Homo sapiens (Human))
Probiodrug
Ligand
BDBM7942
(1-Subsituted 1H-imidazole, 8 | 1-Vinylimidazole | ...)
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Affinity Data
Ki: 4.90E+4nM ΔG°: -25.0kJ/mole
pH: 8.0 T: 2°C
Assay Description:
QC activity was evaluated fluorometrically using Gln-AMC as substrate, and pyroglutamyl peptidase as the auxiliary enzyme. After conversion of Gln-AM...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
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MMDB
PC cid
PC sid
PDB
Patents
In Depth
Details
Article
PubMed
MMDB
PDB
3D Structure (crystal)
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Target
Cytochrome P450 3A4
(Homo sapiens (Human))
The Procter & Gamble
US Patent
Ligand
BDBM7942
(1-Subsituted 1H-imidazole, 8 | 1-Vinylimidazole | ...)
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Affinity Data
IC50: >1.00E+4nM
Assay Description:
A commercially available P450-GLO Assay kit (Promega Corporation, Madison Wis.) is used to screen various compounds for CYP3A4A inhibition activity. ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
MMDB
PC cid
PC sid
PDB
Patents
In Depth
Details
US Patent
Copy BDB DOI
Target
Cytochrome P450 3A4
(Homo sapiens (Human))
The Procter & Gamble
US Patent
Ligand
BDBM7942
(1-Subsituted 1H-imidazole, 8 | 1-Vinylimidazole | ...)
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Affinity Data
IC50: >1.00E+4nM
Assay Description:
Cytochrome P450 is a large and diverse group of enzymes that catalyze the oxidation of organic substances. Some members of the CYP family contribute ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
MMDB
PC cid
PC sid
PDB
Patents
In Depth
Details
US Patent
Copy BDB DOI
Target
Cytochrome P450 2A6
(Homo sapiens (Human))
University of Basel
Ligand
BDBM7942
(1-Subsituted 1H-imidazole, 8 | 1-Vinylimidazole | ...)
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Affinity Data
IC50: >3.00E+5nM
pH: 7.6 T: 2°C
Assay Description:
Inhibition assay using cytochrome P450 enzyme CYP2A6 and CYP2A13.
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
MMDB
PC cid
PC sid
PDB
Patents
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Cytochrome P450 2A13
(Homo sapiens (Human))
University of Basel
Ligand
BDBM7942
(1-Subsituted 1H-imidazole, 8 | 1-Vinylimidazole | ...)
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Copy InChI
Affinity Data
IC50: >3.00E+5nM
pH: 7.6 T: 2°C
Assay Description:
Inhibition assay using cytochrome P450 enzyme CYP2A6 and CYP2A13.
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
MMDB
PC cid
PC sid
PDB
Patents
In Depth
Details
Article
PubMed
Copy BDB DOI