BDBM50097768 CHEMBL163112::N-[(R)-2-(4-Benzyl-piperazin-1-yl)-2-oxo-1-phenyl-ethyl]-3-carbamimidoyl-benzamide

SMILES NC(=N)c1cccc(c1)C(=O)N[C@@H](C(=O)N1CCN(Cc2ccccc2)CC1)c1ccccc1

InChI Key InChIKey=IBWGEULGEOTIMC-UHFFFAOYSA-N

Data  3 KI

  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 3 hits for monomerid = 50097768   

TargetCoagulation factor X(Human)
Prosthetics Molecular Design

Curated by ChEMBL
LigandPNGBDBM50097768(N-[(R)-2-(4-Benzyl-piperazin-1-yl)-2-oxo-1-phenyl-...)
Affinity DataKi:  120nMAssay Description:Binding affinity against human Coagulation factor XaMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetSerine protease 1(Human)
Prosthetics Molecular Design

Curated by ChEMBL
LigandPNGBDBM50097768(N-[(R)-2-(4-Benzyl-piperazin-1-yl)-2-oxo-1-phenyl-...)
Affinity DataKi:  2.20E+3nMAssay Description:Binding affinity against human trypsinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetProthrombin(Human)
Prosthetics Molecular Design

Curated by ChEMBL
LigandPNGBDBM50097768(N-[(R)-2-(4-Benzyl-piperazin-1-yl)-2-oxo-1-phenyl-...)
Affinity DataKi:  7.94E+3nMAssay Description:Affinity for human thrombinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed