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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
8
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Target
Cytochrome P450 1A2
(Homo sapiens (Human))
De Montfort University
Curated by
ChEMBL
Ligand
BDBM49471
((E)-3-(3-methoxyphenyl)-1-(1H-pyrrol-2-yl)-2-prope...)
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Affinity Data
IC50: 1.50E+3nM
Assay Description:
Inhibition of human CYP1A2 bound to yeast microsomal membrane using 3-cyano-7-ethoxycoumarin as substrate after 10 mins by fluorescence assay
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 1B1
(Homo sapiens (Human))
De Montfort University
Curated by
ChEMBL
Ligand
BDBM49471
((E)-3-(3-methoxyphenyl)-1-(1H-pyrrol-2-yl)-2-prope...)
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Affinity Data
IC50: 5.20E+3nM
Assay Description:
Inhibition of human CYP1B1 bound to yeast microsomal membrane using 7-ethoxyresorufin as substrate after 10 mins by fluorescence assay
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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PC cid
PC sid
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In Depth
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Article
PubMed
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Target
Cytochrome P450 1A1
(Homo sapiens (Human))
De Montfort University
Curated by
ChEMBL
Ligand
BDBM49471
((E)-3-(3-methoxyphenyl)-1-(1H-pyrrol-2-yl)-2-prope...)
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Copy InChI
Affinity Data
IC50: 6.20E+3nM
Assay Description:
Inhibition of human CYP1A1 bound to yeast microsomal membrane using 7-ethoxyresorufin as substrate after 10 mins by fluorescence assay
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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PC cid
PC sid
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In Depth
Details
Article
PubMed
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Target
Cytochrome P450 2D6
(Homo sapiens (Human))
De Montfort University
Curated by
ChEMBL
Ligand
BDBM49471
((E)-3-(3-methoxyphenyl)-1-(1H-pyrrol-2-yl)-2-prope...)
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Affinity Data
IC50: 1.10E+4nM
Assay Description:
Inhibition of human CYP2D6 bound to yeast microsomal membrane using 7-ethoxy-methyloxy-3-cyanocoumarin as substrate after 10 mins by fluorescence ass...
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
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GoogleScholar
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PC sid
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In Depth
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Article
PubMed
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Target
Cytochrome P450 2C19
(Homo sapiens (Human))
De Montfort University
Curated by
ChEMBL
Ligand
BDBM49471
((E)-3-(3-methoxyphenyl)-1-(1H-pyrrol-2-yl)-2-prope...)
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Affinity Data
IC50: >2.00E+4nM
Assay Description:
Inhibition of human CYP2C19 bound to yeast microsomal membrane using 3-cyano-7-ethoxycoumarin as substrate after 10 mins by fluorescence assay
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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PC cid
PC sid
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In Depth
Details
Article
PubMed
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Target
Cytochrome P450 2C9
(Homo sapiens (Human))
De Montfort University
Curated by
ChEMBL
Ligand
BDBM49471
((E)-3-(3-methoxyphenyl)-1-(1H-pyrrol-2-yl)-2-prope...)
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Copy InChI
Affinity Data
IC50: >2.00E+4nM
Assay Description:
Inhibition of human CYP2C9 bound to yeast microsomal membrane using 3-cyano-7-ethoxycoumarin as substrate after 10 mins by fluorescence assay
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
PC cid
PC sid
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In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Cytochrome P450 3A4
(Homo sapiens (Human))
De Montfort University
Curated by
ChEMBL
Ligand
BDBM49471
((E)-3-(3-methoxyphenyl)-1-(1H-pyrrol-2-yl)-2-prope...)
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Affinity Data
IC50: >2.00E+4nM
Assay Description:
Inhibition of human CYP3A4 bound to yeast microsomal membrane using dibenzylfluorescein as substrate after 10 mins by fluorescence assay
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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PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
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Target
Transcription factor p65
(Homo sapiens (Human))
Srmlsc
Curated by
PubChem BioAssay
Ligand
BDBM49471
((E)-3-(3-methoxyphenyl)-1-(1H-pyrrol-2-yl)-2-prope...)
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Affinity Data
EC50: 1.49E+4nM
Assay Description:
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
Ligand Info
Purchase
PC cid
PC sid
Similars
In Depth
Details
PCBioAssay
Copy BDB DOI