BDBM50608359 CHEMBL5287333

SMILES CC(C)CC1NC(=O)C(CC(O)=O)NC(=O)C(CCC(N)=O)NC(=O)C(Cc2c[nH]cn2)NCC(C)NC(=O)C2CSCc3cc(CSCC(NC(C)=O)C(=O)NC(CO)C(=O)NC(Cc4ccccc4)C(=O)N4CCC4C(=O)NC(Cc4ccc(O)cc4)C(=O)NC(CCCNC(N)=N)C(=O)N2)cc(CSC(NC1=O)C(N)=O)c3

InChI Key InChIKey=NATBJNOLJXJRBB-UHFFFAOYSA-N

Data  4 KI  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50608359   

TargetProthrombin(Human)
Hefei University of Technology

Curated by ChEMBL
LigandPNGBDBM50608359(CHEMBL5287333)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of human thrombin using Z-GGR-AMC as substrate assessed as inhibition constant by fluorescence plate reader analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed
TargetPlasminogen(Human)
Hefei University of Technology

Curated by ChEMBL
LigandPNGBDBM50608359(CHEMBL5287333)
Affinity DataKi:  2.90nMAssay Description:Inhibition of human plasmin using H-d-VLK-AM as substrate assessed as inhibition constant by fluorescence plate reader analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed
TargetPlasma kallikrein(Rat)
Hefei University of Technology

Curated by ChEMBL
LigandPNGBDBM50608359(CHEMBL5287333)
Affinity DataKi:  6.60nMAssay Description:Inhibition of rat recombinant plasma kallikrein using Z-FR-AMC as substrate assessed as inhibition constant by fluorescence plate reader analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed
TargetCoagulation factor XI(Human)
Hefei University of Technology

Curated by ChEMBL
LigandPNGBDBM50608359(CHEMBL5287333)
Affinity DataKi: >5.00E+4nMAssay Description:Inhibition of human fXIa using Boc-FSR-AMC as substrate assessed as inhibition constant by fluorescence plate reader analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed
TargetCoagulation factor XII(Human)
Hefei University of Technology

Curated by ChEMBL
LigandPNGBDBM50608359(CHEMBL5287333)
Affinity DataKi: >5.00E+4nMAssay Description:Inhibition of human fXIIa using Z-GGR-AMC as substrate assessed as inhibition constant by fluorescence plate reader analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed