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Compile Data Set for Download or QSAR
maximum 50k data
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
(change energy unit to
kcal/mol
)
Found
16
hits in this display
Target
Prostaglandin G/H synthase 1
(Ovis aries (Sheep))
Eberhard Karls University Tuebingen
Curated by
ChEMBL
Ligand
BDBM50273441
((R)-2-(4-Chloro-6-(4'-cyanobiphenyl-4-ylamino)pyri...)
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Affinity Data
IC50: >10nM
Assay Description:
Inhibition of ovine COX1
More data for this Ligand-Target Pair
Target Info
PDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
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Target
Prostaglandin G/H synthase 2
(Homo sapiens (Human))
Eberhard Karls University Tuebingen
Curated by
ChEMBL
Ligand
BDBM50273389
(2-(4-Chloro-6-(4'-cyanobiphenyl-4-ylamino)pyrimidi...)
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Copy InChI
Affinity Data
IC50: >10nM
Assay Description:
Inhibition of human recombinant COX2
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Prostaglandin G/H synthase 2
(Homo sapiens (Human))
Eberhard Karls University Tuebingen
Curated by
ChEMBL
Ligand
BDBM50273390
((S)-2-(4-Chloro-6-(4'-cyanobiphenyl-4-ylamino)pyri...)
Copy SMILES
Copy InChI
Affinity Data
IC50: >10nM
Assay Description:
Inhibition of human recombinant COX2
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Prostaglandin G/H synthase 2
(Homo sapiens (Human))
Eberhard Karls University Tuebingen
Curated by
ChEMBL
Ligand
BDBM50273441
((R)-2-(4-Chloro-6-(4'-cyanobiphenyl-4-ylamino)pyri...)
Copy SMILES
Copy InChI
Affinity Data
IC50: >10nM
Assay Description:
Inhibition of human recombinant COX2
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Prostaglandin G/H synthase 1
(Ovis aries (Sheep))
Eberhard Karls University Tuebingen
Curated by
ChEMBL
Ligand
BDBM50273390
((S)-2-(4-Chloro-6-(4'-cyanobiphenyl-4-ylamino)pyri...)
Copy SMILES
Copy InChI
Affinity Data
IC50: >10nM
Assay Description:
Inhibition of ovine COX1
More data for this Ligand-Target Pair
Target Info
PDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Prostaglandin G/H synthase 1
(Ovis aries (Sheep))
Eberhard Karls University Tuebingen
Curated by
ChEMBL
Ligand
BDBM50273389
(2-(4-Chloro-6-(4'-cyanobiphenyl-4-ylamino)pyrimidi...)
Copy SMILES
Copy InChI
Affinity Data
IC50: >10nM
Assay Description:
Inhibition of ovine COX1
More data for this Ligand-Target Pair
Target Info
PDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human))
Goethe-University Frankfurt
Curated by
ChEMBL
Ligand
BDBM50273389
(2-(4-Chloro-6-(4'-cyanobiphenyl-4-ylamino)pyrimidi...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 190nM
Assay Description:
Activation of human PPARalpha ligand binding domain expressed in COS7 cells by luciferase reporter gene assay
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
UniProtKB/SwissProt
antibodypedia
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Polyunsaturated fatty acid 5-lipoxygenase
(Homo sapiens (Human))
Eberhard Karls University Tuebingen
Curated by
ChEMBL
Ligand
BDBM50273389
(2-(4-Chloro-6-(4'-cyanobiphenyl-4-ylamino)pyrimidi...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 400nM
Assay Description:
Inhibition of 5-LO in PMNL cells
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Polyunsaturated fatty acid 5-lipoxygenase
(Homo sapiens (Human))
Eberhard Karls University Tuebingen
Curated by
ChEMBL
Ligand
BDBM50273441
((R)-2-(4-Chloro-6-(4'-cyanobiphenyl-4-ylamino)pyri...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 800nM
Assay Description:
Inhibition of human recombinant 5-LO expressed in Escherichia coli by cell-free assay
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Polyunsaturated fatty acid 5-lipoxygenase
(Homo sapiens (Human))
Eberhard Karls University Tuebingen
Curated by
ChEMBL
Ligand
BDBM50273390
((S)-2-(4-Chloro-6-(4'-cyanobiphenyl-4-ylamino)pyri...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 1.50E+3nM
Assay Description:
Inhibition of human recombinant 5-LO expressed in Escherichia coli by cell-free assay
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Polyunsaturated fatty acid 5-lipoxygenase
(Homo sapiens (Human))
Eberhard Karls University Tuebingen
Curated by
ChEMBL
Ligand
BDBM50273389
(2-(4-Chloro-6-(4'-cyanobiphenyl-4-ylamino)pyrimidi...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 1.50E+3nM
Assay Description:
Inhibition of human recombinant 5-LO expressed in Escherichia coli by cell-free assay
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human))
Goethe-University Frankfurt
Curated by
ChEMBL
Ligand
BDBM50273389
(2-(4-Chloro-6-(4'-cyanobiphenyl-4-ylamino)pyrimidi...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 1.50E+3nM
Assay Description:
Activation of human PPARgamma ligand binding domain expressed in COS7 cells by luciferase reporter gene assay
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Prostaglandin E synthase
(Homo sapiens (Human))
Eberhard Karls University Tuebingen
Curated by
ChEMBL
Ligand
BDBM50273441
((R)-2-(4-Chloro-6-(4'-cyanobiphenyl-4-ylamino)pyri...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 1.60E+3nM
Assay Description:
Inhibition of PGES1 in human A549 cell microsome assessed as PGE2 formation by cell-free assay
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Prostaglandin E synthase
(Homo sapiens (Human))
Eberhard Karls University Tuebingen
Curated by
ChEMBL
Ligand
BDBM50273389
(2-(4-Chloro-6-(4'-cyanobiphenyl-4-ylamino)pyrimidi...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 1.70E+3nM
Assay Description:
Inhibition of PGES1 in human A549 cell microsome assessed as PGE2 formation by cell-free assay
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Prostaglandin E synthase
(Homo sapiens (Human))
Eberhard Karls University Tuebingen
Curated by
ChEMBL
Ligand
BDBM50273441
((R)-2-(4-Chloro-6-(4'-cyanobiphenyl-4-ylamino)pyri...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 1.70E+3nM
Assay Description:
Inhibition of human microsomal PGES1 in cell-free system assessed as inhibition of conversion of PGH2 to PGE2 by HPLC assay
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Prostaglandin E synthase
(Homo sapiens (Human))
Eberhard Karls University Tuebingen
Curated by
ChEMBL
Ligand
BDBM50273390
((S)-2-(4-Chloro-6-(4'-cyanobiphenyl-4-ylamino)pyri...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 2.10E+3nM
Assay Description:
Inhibition of PGES1 in human A549 cell microsome assessed as PGE2 formation by cell-free assay
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI