BDBM50066770 (3R,6S,8aS)-5-Oxo-6-phenylmethanesulfonylamino-hexahydro-thiazolo[3,2-a]pyridine-3-carboxylic acid (3-guanidino-propyl)-amide; TFA::CHEMBL421428

SMILES NC(=N)NCCCNC(=O)[C@@H]1CS[C@H]2CC[C@H](NS(=O)(=O)Cc3ccccc3)C(=O)N12

InChI Key InChIKey=SOIIHESTBYNJRH-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 50066770   

TargetProthrombin(Human)
Novartis Pharma

Curated by ChEMBL
LigandPNGBDBM50066770((3R,6S,8aS)-5-Oxo-6-phenylmethanesulfonylamino-hex...)
Affinity DataKi:  111nMAssay Description:In vitro inhibition was measured against Human Thrombin.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetSerine protease 1(Bovine)
Novartis Pharma

Curated by ChEMBL
LigandPNGBDBM50066770((3R,6S,8aS)-5-Oxo-6-phenylmethanesulfonylamino-hex...)
Affinity DataKi:  7.90E+3nMAssay Description:In vitro inhibition was measured against Human bovine pancreatic trypsin.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetCoagulation factor X(Human)
Novartis Pharma

Curated by ChEMBL
LigandPNGBDBM50066770((3R,6S,8aS)-5-Oxo-6-phenylmethanesulfonylamino-hex...)
Affinity DataKi: >3.37E+4nMAssay Description:In vitro inhibition was measured against Human Coagulation factor XMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed