BDBM14514 (2R)-N-[(1S)-1-{[(2S)-5-carbamimidamido-1-oxo-1-(1,3-thiazol-2-yl)pentan-2-yl]carbamoyl}-2-(pyridin-3-yl)ethyl]-3-phenyl-2-(phenylmethane)sulfonamidopropanamide::CHEMBL78053::Ketothiazole inhibitor 1

SMILES [#7]\[#6](-[#7])=[#7]/[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-c1cccnc1)-[#7]-[#6](=O)-[#6@@H](-[#6]-c1ccccc1)-[#7]S(=O)(=O)[#6]-c1ccccc1)-[#6](=O)-c1nccs1

InChI Key InChIKey=WZVDIBONFQNHPB-UHFFFAOYSA-N

Data  11 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 11 hits for monomerid = 14514   

TargetProthrombin(Human)
Pharmacia

LigandPNGBDBM14514(CHEMBL78053 | (2R)-N-[(1S)-1-{[(2S)-5-carbamimidam...)
Affinity DataIC50: 1.00E+5nMAssay Description:Recombinant human Factor VIIa and soluble tissue factor were added to a 96-well assay plate containing substrate and inhibitor in reaction buffer. Th...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/2/2007
Entry Details Article
PubMed
TargetCoagulation factor VII(Human)
Pharmacia

LigandPNGBDBM14514(CHEMBL78053 | (2R)-N-[(1S)-1-{[(2S)-5-carbamimidam...)
Affinity DataIC50: 200nMpH: 8.0 T: 2°CAssay Description:Recombinant human Factor VIIa and soluble tissue factor were added to a 96-well assay plate containing substrate and inhibitor in reaction buffer. Th...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/2/2007
Entry Details Article
PubMed
TargetProthrombin(Human)
Pharmacia

LigandPNGBDBM14514(CHEMBL78053 | (2R)-N-[(1S)-1-{[(2S)-5-carbamimidam...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibitory activity against thrombin (IIa)More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/7/2012
Entry Details Article
PubMed
TargetCoagulation factor VII(Human)
Pharmacia

LigandPNGBDBM14514(CHEMBL78053 | (2R)-N-[(1S)-1-{[(2S)-5-carbamimidam...)
Affinity DataIC50: 200nMAssay Description:Inhibition of tissue coagulation factor VIIMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/7/2012
Entry Details Article
PubMed
TargetCoagulation factor X(Human)
Pharmacia

Curated by ChEMBL
LigandPNGBDBM14514(CHEMBL78053 | (2R)-N-[(1S)-1-{[(2S)-5-carbamimidam...)
Affinity DataIC50: 290nMAssay Description:Inhibition of coagulation factor XMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/7/2012
Entry Details Article
PubMed
TargetCoagulation factor VII(Human)
Pharmacia

LigandPNGBDBM14514(CHEMBL78053 | (2R)-N-[(1S)-1-{[(2S)-5-carbamimidam...)
Affinity DataIC50: 200nMAssay Description:Inhibitory activity against tissue coagulation factor VII.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/29/2012
Entry Details Article
PubMed
TargetCoagulation factor X(Human)
Pharmacia

Curated by ChEMBL
LigandPNGBDBM14514(CHEMBL78053 | (2R)-N-[(1S)-1-{[(2S)-5-carbamimidam...)
Affinity DataIC50: 290nMAssay Description:Inhibitory activity against coagulation factor X.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/29/2012
Entry Details Article
PubMed
TargetProthrombin(Human)
Pharmacia

LigandPNGBDBM14514(CHEMBL78053 | (2R)-N-[(1S)-1-{[(2S)-5-carbamimidam...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibitory activity against thrombin (IIa).More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/29/2012
Entry Details Article
PubMed
TargetProthrombin(Human)
Pharmacia

LigandPNGBDBM14514(CHEMBL78053 | (2R)-N-[(1S)-1-{[(2S)-5-carbamimidam...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of human alpha-thrombinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2012
Entry Details Article
PubMed
TargetCoagulation factor X(Human)
Pharmacia

Curated by ChEMBL
LigandPNGBDBM14514(CHEMBL78053 | (2R)-N-[(1S)-1-{[(2S)-5-carbamimidam...)
Affinity DataIC50: 290nMAssay Description:Inhibition of human factor 10aMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2012
Entry Details Article
PubMed
TargetCoagulation factor VII(Human)
Pharmacia

LigandPNGBDBM14514(CHEMBL78053 | (2R)-N-[(1S)-1-{[(2S)-5-carbamimidam...)
Affinity DataIC50: 200nMAssay Description:Inhibition of human factor 7aMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2012
Entry Details Article
PubMed