BDBM50116261 (2S,5S)-5-((R)-3-Methyl-2-pyridin-2-yl-butyrylamino)-4-oxo-1,2,4,5,6,7-hexahydro-azepino[3,2,1-hi]indole-2-carboxylic acid (1H-[1,2,3]triazol-4-ylmethyl)-amide::CHEMBL304727

SMILES CC(C)[C@@H](C(=O)N[C@H]1CCc2cccc3C[C@H](N(c23)C1=O)C(=O)NCc1cnn[nH]1)c1ccccn1

InChI Key InChIKey=BTLKDBNKGRJVJE-UHFFFAOYSA-N

Data  1 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50116261   

TargetGranzyme B(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50116261((2S,5S)-5-((R)-3-Methyl-2-pyridin-2-yl-butyrylamin...)
Affinity DataKi:  75nMAssay Description:Inhibition against human granzyme BMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed