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Compile Data Set for Download or QSAR
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Found
21
Enz. Inhib. hit(s) with all data for entry = 5503
Target
Bile salt export pump
(Rat)
University of Tokyo
Curated by
PDSP K
i
Database
Ligand
BDBM22164
(CI 981 | CHEMBL1487 | (3R,5R)-7-[2-(4-fluorophenyl...)
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Affinity Data
Ki: 7.57E+3nM
More data for this Ligand-Target Pair
Target Info
KEGG
UniProtKB/SwissProt
GoogleScholar
Ligand Info
Purchase
ChEBI
CHEMBL
KEGG
PC cid
PC sid
Similars
In Depth
Date in BDB:
6/8/2012
Entry Details
Article
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PubMed
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Target
Bile salt export pump
(Rat)
University of Tokyo
Curated by
PDSP K
i
Database
Ligand
BDBM86705
(CAS_141750-63-2 | Pitavastatin lactone)
Copy SMILES
Copy InChI
Affinity Data
Ki: >1.00E+4nM
More data for this Ligand-Target Pair
Target Info
KEGG
UniProtKB/SwissProt
GoogleScholar
Ligand Info
Purchase
PC cid
PC sid
Similars
In Depth
Date in BDB:
6/8/2012
Entry Details
Article
Copy Entry DOI
PubMed
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Target
Bile salt export pump
(Rat)
University of Tokyo
Curated by
PDSP K
i
Database
Ligand
BDBM50139181
(2,2-dimethylbutyric acid, 8-ester with (4R,6R)-6-(...)
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Affinity Data
Ki: >1.00E+4nM
More data for this Ligand-Target Pair
Target Info
KEGG
UniProtKB/SwissProt
GoogleScholar
Ligand Info
Purchase
ChEBI
DrugBank
PC cid
PC sid
Similars
In Depth
Date in BDB:
6/8/2012
Entry Details
Article
Copy Entry DOI
PubMed
Copy Rxn URL
Target
Bile salt export pump
(Human)
University of Tokyo
Curated by
PDSP K
i
Database
Ligand
BDBM50139181
(2,2-dimethylbutyric acid, 8-ester with (4R,6R)-6-(...)
Copy SMILES
Copy InChI
Affinity Data
Ki: >1.00E+4nM
More data for this Ligand-Target Pair
Target Info
PDB
UniProtKB/SwissProt
GoogleScholar
Ligand Info
Purchase
ChEBI
DrugBank
PC cid
PC sid
Similars
In Depth
Date in BDB:
6/8/2012
Entry Details
Article
Copy Entry DOI
PubMed
Copy Rxn URL
Target
Bile salt export pump
(Rat)
University of Tokyo
Curated by
PDSP K
i
Database
Ligand
BDBM18375
(Simvastatin acid | (3R,5R)-7-[(1S,2S,6R,8S,8aR)-8-...)
Copy SMILES
Copy InChI
Affinity Data
Ki: >1.00E+4nM
More data for this Ligand-Target Pair
Target Info
KEGG
UniProtKB/SwissProt
GoogleScholar
Ligand Info
Purchase
ChEBI
KEGG
PC cid
PC sid
Similars
In Depth
Date in BDB:
6/8/2012
Entry Details
Article
Copy Entry DOI
PubMed
Copy Rxn URL
Target
Bile salt export pump
(Human)
University of Tokyo
Curated by
PDSP K
i
Database
Ligand
BDBM18375
(Simvastatin acid | (3R,5R)-7-[(1S,2S,6R,8S,8aR)-8-...)
Copy SMILES
Copy InChI
Affinity Data
Ki: >1.00E+4nM
More data for this Ligand-Target Pair
Target Info
PDB
UniProtKB/SwissProt
GoogleScholar
Ligand Info
Purchase
ChEBI
KEGG
PC cid
PC sid
Similars
In Depth
Date in BDB:
6/8/2012
Entry Details
Article
Copy Entry DOI
PubMed
Copy Rxn URL
Target
Bile salt export pump
(Rat)
University of Tokyo
Curated by
PDSP K
i
Database
Ligand
BDBM18372
(CHEMBL1496 | Ros | (3R,5S,6E)-7-[4-(4-fluorophenyl...)
Copy SMILES
Copy InChI
Affinity Data
Ki: >1.00E+4nM
More data for this Ligand-Target Pair
Target Info
KEGG
UniProtKB/SwissProt
GoogleScholar
Ligand Info
Purchase
ChEBI
CHEMBL
DrugBank
KEGG
PC cid
PC sid
Similars
In Depth
Date in BDB:
6/8/2012
Entry Details
Article
Copy Entry DOI
PubMed
Copy Rxn URL
Target
Bile salt export pump
(Human)
University of Tokyo
Curated by
PDSP K
i
Database
Ligand
BDBM18372
(CHEMBL1496 | Ros | (3R,5S,6E)-7-[4-(4-fluorophenyl...)
Copy SMILES
Copy InChI
Affinity Data
Ki: >1.00E+4nM
More data for this Ligand-Target Pair
Target Info
PDB
UniProtKB/SwissProt
GoogleScholar
Ligand Info
Purchase
ChEBI
CHEMBL
DrugBank
KEGG
PC cid
PC sid
Similars
In Depth
Date in BDB:
6/8/2012
Entry Details
Article
Copy Entry DOI
PubMed
Copy Rxn URL
Target
Bile salt export pump
(Rat)
University of Tokyo
Curated by
PDSP K
i
Database
Ligand
BDBM86706
(Pravastatin lactone)
Copy SMILES
Copy InChI
Affinity Data
Ki: >1.00E+4nM
More data for this Ligand-Target Pair
Target Info
KEGG
UniProtKB/SwissProt
GoogleScholar
Ligand Info
Purchase
ChEBI
PC cid
PC sid
Similars
In Depth
Date in BDB:
6/8/2012
Entry Details
Article
Copy Entry DOI
PubMed
Copy Rxn URL
Target
Bile salt export pump
(Human)
University of Tokyo
Curated by
PDSP K
i
Database
Ligand
BDBM86706
(Pravastatin lactone)
Copy SMILES
Copy InChI
Affinity Data
Ki: >1.00E+4nM
More data for this Ligand-Target Pair
Target Info
PDB
UniProtKB/SwissProt
GoogleScholar
Ligand Info
Purchase
ChEBI
PC cid
PC sid
Similars
In Depth
Date in BDB:
6/8/2012
Entry Details
Article
Copy Entry DOI
PubMed
Copy Rxn URL
Target
Bile salt export pump
(Rat)
University of Tokyo
Curated by
PDSP K
i
Database
Ligand
BDBM20688
((3R,5R)-7-[(1S,2S,6S,8S,8aR)-6-hydroxy-2-methyl-8-...)
Copy SMILES
Copy InChI
Affinity Data
Ki: >1.00E+4nM
More data for this Ligand-Target Pair
Target Info
KEGG
UniProtKB/SwissProt
GoogleScholar
Ligand Info
Purchase
ChEBI
CHEMBL
DrugBank
KEGG
PC cid
PC sid
Similars
In Depth
Date in BDB:
6/8/2012
Entry Details
Article
Copy Entry DOI
PubMed
Copy Rxn URL
Target
Bile salt export pump
(Human)
University of Tokyo
Curated by
PDSP K
i
Database
Ligand
BDBM20688
((3R,5R)-7-[(1S,2S,6S,8S,8aR)-6-hydroxy-2-methyl-8-...)
Copy SMILES
Copy InChI
Affinity Data
Ki: >1.00E+4nM
More data for this Ligand-Target Pair
Target Info
PDB
UniProtKB/SwissProt
GoogleScholar
Ligand Info
Purchase
ChEBI
CHEMBL
DrugBank
KEGG
PC cid
PC sid
Similars
In Depth
Date in BDB:
6/8/2012
Entry Details
Article
Copy Entry DOI
PubMed
Copy Rxn URL
Target
Bile salt export pump
(Human)
University of Tokyo
Curated by
PDSP K
i
Database
Ligand
BDBM86705
(CAS_141750-63-2 | Pitavastatin lactone)
Copy SMILES
Copy InChI
Affinity Data
Ki: >1.00E+4nM
More data for this Ligand-Target Pair
Target Info
PDB
UniProtKB/SwissProt
GoogleScholar
Ligand Info
Purchase
PC cid
PC sid
Similars
In Depth
Date in BDB:
6/8/2012
Entry Details
Article
Copy Entry DOI
PubMed
Copy Rxn URL
Target
Bile salt export pump
(Rat)
University of Tokyo
Curated by
PDSP K
i
Database
Ligand
BDBM86707
(CAS_147511-69-1 | Pitavastatin)
Copy SMILES
Copy InChI
Affinity Data
Ki: >1.00E+4nM
More data for this Ligand-Target Pair
Target Info
KEGG
UniProtKB/SwissProt
GoogleScholar
Ligand Info
Purchase
ChEBI
DrugBank
KEGG
PC cid
PC sid
Similars
In Depth
Date in BDB:
6/8/2012
Entry Details
Article
Copy Entry DOI
PubMed
Copy Rxn URL
Target
Bile salt export pump
(Human)
University of Tokyo
Curated by
PDSP K
i
Database
Ligand
BDBM86707
(CAS_147511-69-1 | Pitavastatin)
Copy SMILES
Copy InChI
Affinity Data
Ki: >1.00E+4nM
More data for this Ligand-Target Pair
Target Info
PDB
UniProtKB/SwissProt
GoogleScholar
Ligand Info
Purchase
ChEBI
DrugBank
KEGG
PC cid
PC sid
Similars
In Depth
Date in BDB:
6/8/2012
Entry Details
Article
Copy Entry DOI
PubMed
Copy Rxn URL
Target
Bile salt export pump
(Rat)
University of Tokyo
Curated by
PDSP K
i
Database
Ligand
BDBM86704
(CAS_93957-54-1 | Fluvastatin | cid_446155)
Copy SMILES
Copy InChI
Affinity Data
Ki: >1.00E+4nM
More data for this Ligand-Target Pair
Target Info
KEGG
UniProtKB/SwissProt
GoogleScholar
Ligand Info
Purchase
ChEBI
DrugBank
KEGG
PC cid
PC sid
Similars
In Depth
Date in BDB:
6/8/2012
Entry Details
Article
Copy Entry DOI
PubMed
Copy Rxn URL
Target
Bile salt export pump
(Human)
University of Tokyo
Curated by
PDSP K
i
Database
Ligand
BDBM86704
(CAS_93957-54-1 | Fluvastatin | cid_446155)
Copy SMILES
Copy InChI
Affinity Data
Ki: >1.00E+4nM
More data for this Ligand-Target Pair
Target Info
PDB
UniProtKB/SwissProt
GoogleScholar
Ligand Info
Purchase
ChEBI
DrugBank
KEGG
PC cid
PC sid
Similars
In Depth
Date in BDB:
6/8/2012
Entry Details
Article
Copy Entry DOI
PubMed
Copy Rxn URL
Target
Bile salt export pump
(Rat)
University of Tokyo
Curated by
PDSP K
i
Database
Ligand
BDBM18376
((3R,5S,6E)-7-[4-(4-fluorophenyl)-5-(methoxymethyl)...)
Copy SMILES
Copy InChI
Affinity Data
Ki: >1.00E+4nM
More data for this Ligand-Target Pair
Target Info
KEGG
UniProtKB/SwissProt
GoogleScholar
Ligand Info
Purchase
ChEBI
DrugBank
KEGG
PC cid
PC sid
Similars
In Depth
Date in BDB:
6/8/2012
Entry Details
Article
Copy Entry DOI
PubMed
Copy Rxn URL
Target
Bile salt export pump
(Human)
University of Tokyo
Curated by
PDSP K
i
Database
Ligand
BDBM18376
((3R,5S,6E)-7-[4-(4-fluorophenyl)-5-(methoxymethyl)...)
Copy SMILES
Copy InChI
Affinity Data
Ki: >1.00E+4nM
More data for this Ligand-Target Pair
Target Info
PDB
UniProtKB/SwissProt
GoogleScholar
Ligand Info
Purchase
ChEBI
DrugBank
KEGG
PC cid
PC sid
Similars
In Depth
Date in BDB:
6/8/2012
Entry Details
Article
Copy Entry DOI
PubMed
Copy Rxn URL
Target
Bile salt export pump
(Rat)
University of Tokyo
Curated by
PDSP K
i
Database
Ligand
BDBM50011032
(CHEMBL333687 | Atorvastatin lactone | 5-(4-Fluoro-...)
Copy SMILES
Copy InChI
Affinity Data
Ki: >1.00E+4nM
More data for this Ligand-Target Pair
Target Info
KEGG
UniProtKB/SwissProt
GoogleScholar
Ligand Info
Purchase
CHEMBL
PC cid
PC sid
Similars
In Depth
Date in BDB:
6/8/2012
Entry Details
Article
Copy Entry DOI
PubMed
Copy Rxn URL
Target
Bile salt export pump
(Human)
University of Tokyo
Curated by
PDSP K
i
Database
Ligand
BDBM50011032
(CHEMBL333687 | Atorvastatin lactone | 5-(4-Fluoro-...)
Copy SMILES
Copy InChI
Affinity Data
Ki: >1.00E+4nM
More data for this Ligand-Target Pair
Target Info
PDB
UniProtKB/SwissProt
GoogleScholar
Ligand Info
Purchase
CHEMBL
PC cid
PC sid
Similars
In Depth
Date in BDB:
6/8/2012
Entry Details
Article
Copy Entry DOI
PubMed
Copy Rxn URL