Compile Data Set for Download or QSAR
Report error Found 14 Enz. Inhib. hit(s) with all data for entry = 50028539
TargetCytochrome P450 1A2(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50267295(Methyl (S)-1-((2R,4S,5S)-4-Hydroxy-5-((S)-2-(3-((6...)
Affinity DataIC50: 5.00E+3nMAssay Description:Inhibition of CYP1A2 assessed as phenacetin O-deethylationMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50267295(Methyl (S)-1-((2R,4S,5S)-4-Hydroxy-5-((S)-2-(3-((6...)
Affinity DataIC50: 5.00E+3nMAssay Description:Inhibition of CYP2C9 assessed as Tolbutamide hydroxylationMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 2C19(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50267295(Methyl (S)-1-((2R,4S,5S)-4-Hydroxy-5-((S)-2-(3-((6...)
Affinity DataIC50: 5.00E+3nMAssay Description:Inhibition of CYP2C19 assessed as S-mephenytion hydroxylationMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50267295(Methyl (S)-1-((2R,4S,5S)-4-Hydroxy-5-((S)-2-(3-((6...)
Affinity DataIC50: 5.00E+3nMAssay Description:Inhibition of CYP2D6 assessed as dextromethorphan O-demethylationMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 1A2(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50267297(Methyl (S)-1-((2S,4S,5S)-5-((S)-2-(3-Benzyl-2-oxoi...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of CYP1A2 assessed as phenacetin O-deethylationMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50267297(Methyl (S)-1-((2S,4S,5S)-5-((S)-2-(3-Benzyl-2-oxoi...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of CYP2C9 assessed as Tolbutamide hydroxylationMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 2C19(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50267297(Methyl (S)-1-((2S,4S,5S)-5-((S)-2-(3-Benzyl-2-oxoi...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of CYP2C19 assessed as S-mephenytion hydroxylationMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50267297(Methyl (S)-1-((2S,4S,5S)-5-((S)-2-(3-Benzyl-2-oxoi...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of CYP2D6 assessed as dextromethorphan O-demethylationMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50267297(Methyl (S)-1-((2S,4S,5S)-5-((S)-2-(3-Benzyl-2-oxoi...)
Affinity DataKi:  18nMAssay Description:Inhibition of CYP3A4 assessed as midazolam 1'- hydroxylationMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50267295(Methyl (S)-1-((2R,4S,5S)-4-Hydroxy-5-((S)-2-(3-((6...)
Affinity DataKi:  66nMAssay Description:Inhibition of CYP3A4 assessed as midazolam 1'- hydroxylationMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCathepsin D(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50267295(Methyl (S)-1-((2R,4S,5S)-4-Hydroxy-5-((S)-2-(3-((6...)
Affinity DataKi:  540nMAssay Description:Inhibition of cathepsin DMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetRenin(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50267297(Methyl (S)-1-((2S,4S,5S)-5-((S)-2-(3-Benzyl-2-oxoi...)
Affinity DataKi: >4.00E+3nMAssay Description:Inhibition of reninMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCathepsin D(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50267297(Methyl (S)-1-((2S,4S,5S)-5-((S)-2-(3-Benzyl-2-oxoi...)
Affinity DataKi:  4.30E+3nMAssay Description:Inhibition of cathepsin DMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetRenin(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50267295(Methyl (S)-1-((2R,4S,5S)-4-Hydroxy-5-((S)-2-(3-((6...)
Affinity DataKi: >2.00E+4nMAssay Description:Inhibition of reninMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed