BDBM50120426 CHEMBL3617968

SMILES CC1=C([C@H](NC(=O)N1c2cccc(c2)C(F)(F)F)c3ccc(nc3)C#N)C(=O)C

InChI Key InChIKey=PGIVGIFOWOVINL-UHFFFAOYSA-N

Data  3 KI  22 IC50

PDB links: 1 PDB ID matches this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 25 hits for monomerid = 50120426   

TargetNeutrophil elastase(Human)
Bayer Healthcare

Curated by ChEMBL
LigandPNGBDBM50120426(CHEMBL3617968)
Affinity DataKi:  15nMAssay Description:Inhibition of human neutrophil elastase using MeOSuc-AAPV-AMC as substrate after 60 mins by fluorescence assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/3/2016
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetNeutrophil elastase(Human)
Bayer Healthcare

Curated by ChEMBL
LigandPNGBDBM50120426(CHEMBL3617968)
Affinity DataKi:  15nMAssay Description:Competitive inhibition of human neutrophil elastase using varying levels of MeOSuc-AAPV-MCA as substrate measured at 60 mins interval for up to sever...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetNeutrophil elastase(Human)
Bayer Healthcare

Curated by ChEMBL
LigandPNGBDBM50120426(CHEMBL3617968)
Affinity DataIC50: 15nMAssay Description:Inhibition of human neutrophil elastase using N-methylsuccinyl-Ala-Ala-Pro-Val-7-amino-4-methylcoumarin as substrate measured every 30 secs for 10 mi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2020
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetNeutrophil elastase(Human)
Bayer Healthcare

Curated by ChEMBL
LigandPNGBDBM50120426(CHEMBL3617968)
Affinity DataIC50: 20nMAssay Description:Inhibition of human neutrophil elastase using MeOSuc-AAPV-MCA as substrate measured at 60 mins interval for up to several hrs by fluorescence assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetNeutrophil elastase(Mouse)
Bayer HealthCare AG

Curated by ChEMBL
LigandPNGBDBM50120426(CHEMBL3617968)
Affinity DataKi:  700nMAssay Description:Competitive inhibition of mouse neutrophil elastase using varying levels of MeOSuc-AAPV-MCA as substrate measured at 60 mins interval for up to sever...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetKallikrein-1(Human)
Bayer HealthCare AG

Curated by ChEMBL
LigandPNGBDBM50120426(CHEMBL3617968)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of kallikrein-1 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetProlyl endopeptidase FAP(Human)
Bayer HealthCare AG

Curated by ChEMBL
LigandPNGBDBM50120426(CHEMBL3617968)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of FAP (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetKallikrein-5(Human)
Bayer HealthCare AG

Curated by ChEMBL
LigandPNGBDBM50120426(CHEMBL3617968)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of kallikrein-5 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetKallikrein-4(Human)
Bayer HealthCare AG

Curated by ChEMBL
LigandPNGBDBM50120426(CHEMBL3617968)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of kallikrein-4 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetKallikrein-12(Human)
Bayer HealthCare AG

Curated by ChEMBL
LigandPNGBDBM50120426(CHEMBL3617968)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of kallikrein-12 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetKallikrein-7(Human)
Bayer HealthCare AG

Curated by ChEMBL
LigandPNGBDBM50120426(CHEMBL3617968)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of kallikrein-7 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetProthrombin(Human)
Bayer HealthCare AG

Curated by ChEMBL
LigandPNGBDBM50120426(CHEMBL3617968)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of thrombin (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetPlasma kallikrein(Human)
Bayer HealthCare AG

Curated by ChEMBL
LigandPNGBDBM50120426(CHEMBL3617968)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of kallikrein-B1 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetCoagulation factor VII(Human)
Bayer HealthCare AG

Curated by ChEMBL
LigandPNGBDBM50120426(CHEMBL3617968)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of FVIIa (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetCathepsin G(Human)
Bayer HealthCare AG

Curated by ChEMBL
LigandPNGBDBM50120426(CHEMBL3617968)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of cathepsin G (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetCoagulation factor X(Human)
Bayer HealthCare AG

Curated by ChEMBL
LigandPNGBDBM50120426(CHEMBL3617968)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of FXa (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetCoagulation factor XI(Human)
Bayer HealthCare AG

Curated by ChEMBL
LigandPNGBDBM50120426(CHEMBL3617968)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of FXIa (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetPlatelet-derived growth factor receptor alpha/beta(Mouse)
Bayer HealthCare AG

Curated by ChEMBL
LigandPNGBDBM50120426(CHEMBL3617968)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of trypsin (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetCoagulation factor IX(Human)
Bayer HealthCare AG

Curated by ChEMBL
LigandPNGBDBM50120426(CHEMBL3617968)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of FIXa (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetChymotrypsinogen B2(Human)
Bayer HealthCare AG

Curated by ChEMBL
LigandPNGBDBM50120426(CHEMBL3617968)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of chymotrypsin (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetDipeptidyl peptidase 2(Human)
Bayer HealthCare AG

Curated by ChEMBL
LigandPNGBDBM50120426(CHEMBL3617968)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of DPP2 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetPlasminogen(Human)
Bayer HealthCare AG

Curated by ChEMBL
LigandPNGBDBM50120426(CHEMBL3617968)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of plasmin (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetChymase(Human)
Bayer HealthCare AG

Curated by ChEMBL
LigandPNGBDBM50120426(CHEMBL3617968)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of chymase (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetUrokinase-type plasminogen activator(Human)
Bayer HealthCare AG

Curated by ChEMBL
LigandPNGBDBM50120426(CHEMBL3617968)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of urokinase (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetDipeptidyl peptidase 4(Human)
Bayer HealthCare AG

Curated by ChEMBL
LigandPNGBDBM50120426(CHEMBL3617968)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of DPP4 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed