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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
23
hits in this display
Target
Cytochrome P450 2C19
(Homo sapiens (Human))
Hanyang University
Curated by
ChEMBL
Ligand
BDBM50237535
(6-Paradol | CHEBI:10137 | CHEMBL2071440)
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Affinity Data
IC50: 3.60E+3nM
Assay Description:
Inhibition of CYP2C19 in human liver microsomes using (S)-mephenytoin as substrate preincubated for 20 mins followed by substrate addition measured a...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
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Target
Cytochrome P450 2C8
(Homo sapiens (Human))
Hanyang University
Curated by
ChEMBL
Ligand
BDBM50237535
(6-Paradol | CHEBI:10137 | CHEMBL2071440)
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Affinity Data
IC50: 3.80E+3nM
Assay Description:
Inhibition of human CYP2C8 using paclitaxel as substrate incubated for 5 mins followed by NADPH addition measured after 30 mins by LC-MS/MS analysis
More data for this Ligand-Target Pair
Target Info
PDB
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KEGG
UniProtKB/SwissProt
B.MOAD
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GoogleScholar
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Target
Cytochrome P450 2C8
(Homo sapiens (Human))
Hanyang University
Curated by
ChEMBL
Ligand
BDBM50237535
(6-Paradol | CHEBI:10137 | CHEMBL2071440)
Copy SMILES
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Affinity Data
IC50: 5.10E+3nM
Assay Description:
Inhibition of CYP2C8 in human liver microsomes assessed as enzyme-mediated metabolite formation using paclitaxel as substrate incubated for 5 mins fo...
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
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CHEMBL
MCE
KEGG
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Article
PubMed
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Target
Cytochrome P450 2C19
(Homo sapiens (Human))
Hanyang University
Curated by
ChEMBL
Ligand
BDBM50237535
(6-Paradol | CHEBI:10137 | CHEMBL2071440)
Copy SMILES
Copy InChI
Affinity Data
IC50: 5.80E+3nM
Assay Description:
Inhibition of human CYP2C19 using (S)-mephenytoin as substrate incubated for 5 mins followed by NADPH addition measured after 30 mins by LC-MS/MS ana...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
CHEMBL
MCE
KEGG
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Cytochrome P450 2B6
(Homo sapiens (Human))
Hanyang University
Curated by
ChEMBL
Ligand
BDBM50237535
(6-Paradol | CHEBI:10137 | CHEMBL2071440)
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Affinity Data
IC50: 6.20E+3nM
Assay Description:
In vitro agonist potency was evaluated in HEK293 cells transfected with human melanocortin receptor (hMC1R)
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
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CHEMBL
MCE
KEGG
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Article
PubMed
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Target
Cytochrome P450 2B6
(Homo sapiens (Human))
Hanyang University
Curated by
ChEMBL
Ligand
BDBM50237535
(6-Paradol | CHEBI:10137 | CHEMBL2071440)
Copy SMILES
Copy InChI
Affinity Data
IC50: 6.30E+3nM
Assay Description:
Inhibition of CYP2B6 in human liver microsomes using bupropion as substrate preincubated for 20 mins followed by substrate addition measured after 30...
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
CHEMBL
MCE
KEGG
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Article
PubMed
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Target
Cytochrome P450 1A2
(Homo sapiens (Human))
Hanyang University
Curated by
ChEMBL
Ligand
BDBM50237535
(6-Paradol | CHEBI:10137 | CHEMBL2071440)
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Affinity Data
IC50: 7.10E+3nM
Assay Description:
Inhibition of CYP1A2 in human liver microsomes assessed as enzyme-mediated metabolite formation using phenacetin as substrate incubated for 5 mins fo...
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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CHEMBL
MCE
KEGG
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PC sid
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Article
PubMed
Copy BDB DOI
Target
Cytochrome P450 2C8
(Homo sapiens (Human))
Hanyang University
Curated by
ChEMBL
Ligand
BDBM50237535
(6-Paradol | CHEBI:10137 | CHEMBL2071440)
Copy SMILES
Copy InChI
Affinity Data
IC50: 8.30E+3nM
Assay Description:
Inhibition of CYP2C8 in human liver microsomes using paclitaxel as substrate preincubated for 20 mins followed by substrate addition measured after 3...
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
CHEMBL
MCE
KEGG
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Cytochrome P450 2C9
(Homo sapiens (Human))
Hanyang University
Curated by
ChEMBL
Ligand
BDBM50237535
(6-Paradol | CHEBI:10137 | CHEMBL2071440)
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Affinity Data
IC50: 9.90E+3nM
Assay Description:
Inhibition of CYP2C9 in human liver microsomes using diclofenac as substrate preincubated for 20 mins followed by substrate addition measured after 3...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
CHEMBL
MCE
KEGG
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Cytochrome P450 2C9
(Homo sapiens (Human))
Hanyang University
Curated by
ChEMBL
Ligand
BDBM50237535
(6-Paradol | CHEBI:10137 | CHEMBL2071440)
Copy SMILES
Copy InChI
Affinity Data
IC50: 1.05E+4nM
Assay Description:
Inhibition of human CYP2C9 using diclofenac as substrate incubated for 5 mins followed by NADPH addition measured after 30 mins by LC-MS/MS analysis
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
CHEMBL
MCE
KEGG
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Cytochrome P450 2C9
(Homo sapiens (Human))
Hanyang University
Curated by
ChEMBL
Ligand
BDBM50237535
(6-Paradol | CHEBI:10137 | CHEMBL2071440)
Copy SMILES
Copy InChI
Affinity Data
IC50: 1.36E+4nM
Assay Description:
Inhibition of CYP2C9 in human liver microsomes assessed as enzyme-mediated metabolite formation using diclofenac as substrate incubated for 5 mins fo...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
CHEMBL
MCE
KEGG
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Cytochrome P450 2B6
(Homo sapiens (Human))
Hanyang University
Curated by
ChEMBL
Ligand
BDBM50237535
(6-Paradol | CHEBI:10137 | CHEMBL2071440)
Copy SMILES
Copy InChI
Affinity Data
IC50: 1.54E+4nM
Assay Description:
Inhibition of CYP2B6 in human liver microsomes assessed as enzyme-mediated metabolite formation using bupropion as substrate incubated for 5 mins fol...
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
CHEMBL
MCE
KEGG
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Cytochrome P450 2C19
(Homo sapiens (Human))
Hanyang University
Curated by
ChEMBL
Ligand
BDBM50237535
(6-Paradol | CHEBI:10137 | CHEMBL2071440)
Copy SMILES
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Affinity Data
IC50: 1.76E+4nM
Assay Description:
In vitro agonist potency was evaluated in HEK293 cells transfected with human melanocortin receptor (hMC4R)
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
CHEMBL
MCE
KEGG
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Cytochrome P450 1A2
(Homo sapiens (Human))
Hanyang University
Curated by
ChEMBL
Ligand
BDBM50237535
(6-Paradol | CHEBI:10137 | CHEMBL2071440)
Copy SMILES
Copy InChI
Affinity Data
IC50: 1.96E+4nM
Assay Description:
In vitro agonist potency was evaluated in HEK293 cells transfected with human melanocortin receptor (hMC4R)
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
CHEMBL
MCE
KEGG
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Cytochrome P450 1A2
(Homo sapiens (Human))
Hanyang University
Curated by
ChEMBL
Ligand
BDBM50237535
(6-Paradol | CHEBI:10137 | CHEMBL2071440)
Copy SMILES
Copy InChI
Affinity Data
IC50: 2.14E+4nM
Assay Description:
Inhibition of human CYP1A2 using phenacetin as substrate incubated for 5 mins followed by NADPH addition measured after 30 mins by LC-MS/MS analysis
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
CHEMBL
MCE
KEGG
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Cytochrome P450 3A4
(Homo sapiens (Human))
Hanyang University
Curated by
ChEMBL
Ligand
BDBM50237535
(6-Paradol | CHEBI:10137 | CHEMBL2071440)
Copy SMILES
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Affinity Data
IC50: >3.00E+4nM
Assay Description:
Inhibition of CYP3A4 in human liver microsomes using testosterone as substrate preincubated for 20 mins followed by substrate addition measured after...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
CHEMBL
MCE
KEGG
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Cytochrome P450 2A6
(Homo sapiens (Human))
Hanyang University
Curated by
ChEMBL
Ligand
BDBM50237535
(6-Paradol | CHEBI:10137 | CHEMBL2071440)
Copy SMILES
Copy InChI
Affinity Data
IC50: >3.00E+4nM
Assay Description:
In vitro agonist potency was evaluated in HEK293 cells transfected with human melanocortin receptor (hMC1R)
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
CHEMBL
MCE
KEGG
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Cytochrome P450 3A4
(Homo sapiens (Human))
Hanyang University
Curated by
ChEMBL
Ligand
BDBM50237535
(6-Paradol | CHEBI:10137 | CHEMBL2071440)
Copy SMILES
Copy InChI
Affinity Data
IC50: >3.00E+4nM
Assay Description:
Inhibition of CYP3A4 in human liver microsomes using midazolam as substrate preincubated for 20 mins followed by substrate addition measured after 30...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
CHEMBL
MCE
KEGG
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Cytochrome P450 2D6
(Homo sapiens (Human))
Hanyang University
Curated by
ChEMBL
Ligand
BDBM50237535
(6-Paradol | CHEBI:10137 | CHEMBL2071440)
Copy SMILES
Copy InChI
Affinity Data
IC50: >3.00E+4nM
Assay Description:
Inhibition of CYP2D6 in human liver microsomes assessed as enzyme-mediated metabolite formation using dextromethorphan as substrate incubated for 5 m...
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
UniProtKB/SwissProt
GoogleScholar
Ligand Info
Purchase
CHEMBL
MCE
KEGG
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Cytochrome P450 3A4
(Homo sapiens (Human))
Hanyang University
Curated by
ChEMBL
Ligand
BDBM50237535
(6-Paradol | CHEBI:10137 | CHEMBL2071440)
Copy SMILES
Copy InChI
Affinity Data
IC50: 3.00E+4nM
Assay Description:
Inhibition of CYP3A4 in human liver microsomes assessed as enzyme-mediated metabolite formation using testosterone as substrate incubated for 5 mins ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
CHEMBL
MCE
KEGG
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Cytochrome P450 2A6
(Homo sapiens (Human))
Hanyang University
Curated by
ChEMBL
Ligand
BDBM50237535
(6-Paradol | CHEBI:10137 | CHEMBL2071440)
Copy SMILES
Copy InChI
Affinity Data
IC50: >3.00E+4nM
Assay Description:
Binding affinity towards human melanocortin 4 receptor (hMC4R)
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
CHEMBL
MCE
KEGG
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Cytochrome P450 3A4
(Homo sapiens (Human))
Hanyang University
Curated by
ChEMBL
Ligand
BDBM50237535
(6-Paradol | CHEBI:10137 | CHEMBL2071440)
Copy SMILES
Copy InChI
Affinity Data
IC50: >3.00E+4nM
Assay Description:
Inhibition of CYP3A4 in human liver microsomes assessed as enzyme-mediated metabolite formation using midazolam as substrate incubated for 5 mins fol...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
CHEMBL
MCE
KEGG
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Cytochrome P450 2D6
(Homo sapiens (Human))
Hanyang University
Curated by
ChEMBL
Ligand
BDBM50237535
(6-Paradol | CHEBI:10137 | CHEMBL2071440)
Copy SMILES
Copy InChI
Affinity Data
IC50: >3.00E+4nM
Assay Description:
Binding affinity towards human melanocortin 4 receptor (hMC4R)
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
UniProtKB/SwissProt
GoogleScholar
Ligand Info
Purchase
CHEMBL
MCE
KEGG
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI