BDBM50511167 CHEMBL4563187

SMILES N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)NCc1ccnc(N)c1

InChI Key InChIKey=LOSWCWUZWRHVLI-UHFFFAOYSA-N

Data  1 KI  2 Kd

PDB links: 2 PDB IDs match this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50511167   

TargetProthrombin(Human)
Philipps-University Marburg

Curated by ChEMBL
LigandPNGBDBM50511167(CHEMBL4563187)
Affinity DataKd:  916nMAssay Description:Binding affinity to human alpha-thrombin in phosphate/HEPES/Tricine/Tris buffer by ITC methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/20/2021
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetSerine protease 1(Bovine)
Philipps-University Marburg

Curated by ChEMBL
LigandPNGBDBM50511167(CHEMBL4563187)
Affinity DataKd:  38nMAssay Description:Binding affinity to bovine beta-trypsin in phosphate/HEPES/Tricine/Tris buffer by ITC methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/20/2021
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetProthrombin(Human)
Philipps-University Marburg

Curated by ChEMBL
LigandPNGBDBM50511167(CHEMBL4563187)
Affinity DataKi:  379nMAssay Description:Inhibition of human alpha-thrombin using varying levels of Tos-Gly-Pro-Arg-AMC-TFA as substrate by fluorescence based Michaelis-Menten equation analy...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/20/2021
Entry Details Article
PubMedPDB3D3D Structure (crystal)