BDBM50111105 (S)-1-((R)-2-Methanesulfonylamino-3,3-diphenyl-propionyl)-pyrrolidine-2-carboxylic acid (5-carbamimidoyl-thiophen-2-ylmethyl)-amide::1-(2-Methanesulfonylamino-3,3-diphenyl-propionyl)-pyrrolidine-2-carboxylic acid (5-carbamimidoyl-thiophen-2-ylmethyl)-amide; compound with benzamidine::CHEMBL1795037::CHEMBL7895

SMILES CS(=O)(=O)N[C@H](C(c1ccccc1)c1ccccc1)C(=O)N1CCC[C@H]1C(=O)NCc1ccc(s1)C(N)=N

InChI Key InChIKey=CRPPBRFZGAUWJM-UHFFFAOYSA-N

Data  4 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 4 hits for monomerid = 50111105   

TargetProthrombin(Human)
Life Science R & D, Lgci

Curated by ChEMBL
LigandPNGBDBM50111105(CHEMBL1795037 | CHEMBL7895 | (S)-1-((R)-2-Methanes...)
Affinity DataKi:  0.00500nMAssay Description:Binding affinity against human thrombinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/6/2012
Entry Details Article
PubMed
TargetProthrombin(Human)
Life Science R & D, Lgci

Curated by ChEMBL
LigandPNGBDBM50111105(CHEMBL1795037 | CHEMBL7895 | (S)-1-((R)-2-Methanes...)
Affinity DataKi:  0.00500nMAssay Description:In vitro inhibition constant (Ki) against human thrombinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/29/2012
Entry Details Article
PubMed
TargetSerine protease 1(Bovine)
Life Science R & D, Lgci

Curated by ChEMBL
LigandPNGBDBM50111105(CHEMBL1795037 | CHEMBL7895 | (S)-1-((R)-2-Methanes...)
Affinity DataKi:  0.600nMAssay Description:Binding affinity against bovine trypsinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/6/2012
Entry Details Article
PubMed
TargetCoagulation factor X(Human)
Life Science R & D, Lgci

Curated by ChEMBL
LigandPNGBDBM50111105(CHEMBL1795037 | CHEMBL7895 | (S)-1-((R)-2-Methanes...)
Affinity DataKi:  360nMAssay Description:Compound was evaluated for the binding affinity against human Coagulation factor XaMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/6/2012
Entry Details Article
PubMed