BDBM50290018 (3S,6S,9aS)-6-Acetylamino-5-oxo-octahydro-pyrrolo[1,2-a]azepine-3-carboxylic acid ((S)-1-carbamimidoyl-2-hydroxy-piperidin-3-yl)-amide; hydrochloride::CHEMBL557616

SMILES CC(=O)N[C@H]1CCC[C@H]2CC[C@H](N2C1=O)C(=O)N[C@H]1CCCN(C1O)C(N)=N

InChI Key InChIKey=KKRSGCJSFZAGFA-UHFFFAOYSA-N

Data  3 IC50

  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 3 hits for monomerid = 50290018   

TargetProthrombin(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50290018((3S,6S,9aS)-6-Acetylamino-5-oxo-octahydro-pyrrolo[...)
Affinity DataIC50: 4.30E+3nMAssay Description:In vitro ability to inhibit the activity of human alpha ThrombinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/27/2012
Entry Details Article

TargetSerine protease 1(Bovine)
TBA

Curated by ChEMBL
LigandPNGBDBM50290018((3S,6S,9aS)-6-Acetylamino-5-oxo-octahydro-pyrrolo[...)
Affinity DataIC50: 2.40E+4nMAssay Description:In vitro ability to inhibit the activity of TrypsinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/27/2012
Entry Details Article

TargetPlasminogen(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50290018((3S,6S,9aS)-6-Acetylamino-5-oxo-octahydro-pyrrolo[...)
Affinity DataIC50: 7.40E+4nMAssay Description:In vitro ability to inhibit the activity of PlasminMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/27/2012
Entry Details Article