BDBM674464 NMePip-Phe-hPhe-VSPh::US20240150396, Compound K11777

SMILES CN1CCN(CC1)C(=O)NC(Cc2ccccc2)C(=O)NC(CCc3ccccc3)CCS(=O)(=O)c4ccccc4

InChI Key InChIKey=VZSXPUDQSLKVIR-UHFFFAOYSA-N

Data  6 KI

PDB links: 4 PDB IDs match this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 674464   

TargetProcathepsin L(Human)
Texas A&M University

US Patent
LigandPNGBDBM674464(NMePip-Phe-hPhe-VSPh | US20240150396, Compound K11...)
Affinity DataKi:  0.200nMAssay Description:All enzyme assays were performed at 25° C. Initial rates of the peptidolytic reaction catalyzed by cruzain were measured by monitoring the fluorescen...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/9/2024
Entry Details
Go to US Patent
PDB3D3D Structure (crystal)
TargetCathepsin S(Human)
Texas A&M University

US Patent
LigandPNGBDBM674464(NMePip-Phe-hPhe-VSPh | US20240150396, Compound K11...)
Affinity DataKi:  0.600nMAssay Description:All enzyme assays were performed at 25° C. Initial rates of the peptidolytic reaction catalyzed by cruzain were measured by monitoring the fluorescen...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/9/2024
Entry Details
Go to US Patent

TargetCruzipain(Trypanosoma cruzi)
Texas A&M University

US Patent
LigandPNGBDBM674464(NMePip-Phe-hPhe-VSPh | US20240150396, Compound K11...)
Affinity DataKi:  2nMAssay Description:All enzyme assays were performed at 25° C. Initial rates of the peptidolytic reaction catalyzed by cruzain were measured by monitoring the fluorescen...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/9/2024
Entry Details
Go to US Patent

TargetCruzipain(Trypanosoma cruzi)
Texas A&M University

US Patent
LigandPNGBDBM674464(NMePip-Phe-hPhe-VSPh | US20240150396, Compound K11...)
Affinity DataKi:  2nMAssay Description:All enzyme assays were performed at 25° C. Initial rates of the peptidolytic reaction catalyzed by cruzain were measured by monitoring the fluorescen...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/9/2024
Entry Details
Go to US Patent

TargetCruzipain(Trypanosoma cruzi)
Texas A&M University

US Patent
LigandPNGBDBM674464(NMePip-Phe-hPhe-VSPh | US20240150396, Compound K11...)
Affinity DataKi:  2nMAssay Description:All enzyme assays were performed at 25° C. Initial rates of the peptidolytic reaction catalyzed by cruzain were measured by monitoring the fluorescen...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/9/2024
Entry Details
Go to US Patent

TargetCathepsin B(Human)
Texas A&M University

US Patent
LigandPNGBDBM674464(NMePip-Phe-hPhe-VSPh | US20240150396, Compound K11...)
Affinity DataKi:  5.70nMAssay Description:All enzyme assays were performed at 25° C. Initial rates of the peptidolytic reaction catalyzed by cruzain were measured by monitoring the fluorescen...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/9/2024
Entry Details
Go to US Patent
PDB3D3D Structure (crystal)