BDBM50080896 CHEMBL402843::N-[(S)-1-(1-Carbamimidoyl-piperidin-3-ylmethyl)-2-oxo-2-thiazol-2-yl-ethyl]-2-[(S)-2-methyl-3,6-dioxo-4-(3-phenyl-propyl)-piperazin-1-yl]-acetamide

SMILES [H][C@@]1(C[C@H](NC(=O)CN2[C@@H](C)C(=O)N(CCCc3ccccc3)CC2=O)C(=O)c2nccs2)CCCN(C1)C(N)=N

InChI Key InChIKey=IWOJWBTVEOHVDZ-UHFFFAOYSA-N

Data  1 KI  2 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 3 hits for monomerid = 50080896   

TargetSerine protease 1(Human)
Warner-Lambert

Curated by ChEMBL
LigandPNGBDBM50080896(N-[(S)-1-(1-Carbamimidoyl-piperidin-3-ylmethyl)-2-...)
Affinity DataIC50: 2.40E+4nMAssay Description:Inhibitory activity against human trypsinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetProthrombin(Human)
Warner-Lambert

Curated by ChEMBL
LigandPNGBDBM50080896(N-[(S)-1-(1-Carbamimidoyl-piperidin-3-ylmethyl)-2-...)
Affinity DataIC50: 760nMAssay Description:Inhibitory activity against human thrombinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetProthrombin(Human)
Warner-Lambert

Curated by ChEMBL
LigandPNGBDBM50080896(N-[(S)-1-(1-Carbamimidoyl-piperidin-3-ylmethyl)-2-...)
Affinity DataKi:  65nMAssay Description:Binding affinity against thrombinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed