BDBM50288450 CHEMBL328200::N-[3-((6S,19R,21aR)-6-Benzyl-5,8,17,18,21-pentaoxo-docosahydro-4a,7,16,20-tetraaza-benzocyclononadecen-19-yl)-propyl]-guanidine

SMILES NC(=N)NCCC[C@H]1NC(=O)[C@H]2CCCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CCCCCCCNC(=O)C1=O

InChI Key InChIKey=KNWUAZPNEHMDPN-UHFFFAOYSA-N

Data  2 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50288450   

TargetSerine protease 1(Bovine)
TBA

Curated by ChEMBL
LigandPNGBDBM50288450(N-[3-((6S,19R,21aR)-6-Benzyl-5,8,17,18,21-pentaoxo...)
Affinity DataKi:  66nMAssay Description:Inhibition of bovine trypsinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/21/2010
Entry Details Article

TargetProthrombin(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50288450(N-[3-((6S,19R,21aR)-6-Benzyl-5,8,17,18,21-pentaoxo...)
Affinity DataKi:  86nMAssay Description:Inhibition of human thrombinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/21/2010
Entry Details Article