BDBM50079222 CHEMBL327213::{3-(3-Carbamimidoyl-phenyl)-5-[5-(2-sulfamoyl-phenyl)-pyrimidin-2-ylcarbamoyl]-4,5-dihydro-isoxazol-5-yl}-acetic acid methyl ester; TFA

SMILES COC(=O)CC1(CC(=NO1)c1cccc(c1)C(N)=N)C(=O)Nc1ncc(cn1)-c1ccccc1S(N)(=O)=O

InChI Key InChIKey=LAUGVCLUYPMNEP-UHFFFAOYSA-N

Data  15 KI

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 15 hits for monomerid = 50079222   

TargetCoagulation factor X(Human)
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50079222({3-(3-Carbamimidoyl-phenyl)-5-[5-(2-sulfamoyl-phen...)
Affinity DataKi:  4.30nMAssay Description:Binding affinity towards human purified Coagulation factor Xa (FXa)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetCoagulation factor X(Human)
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50079222({3-(3-Carbamimidoyl-phenyl)-5-[5-(2-sulfamoyl-phen...)
Affinity DataKi:  12nMAssay Description:Binding affinity to purified human coagulation factor Xa (FXa)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/12/2012
Entry Details Article
PubMed
TargetCoagulation factor X(Human)
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50079222({3-(3-Carbamimidoyl-phenyl)-5-[5-(2-sulfamoyl-phen...)
Affinity DataKi:  12nMAssay Description:Binding affinity to purified human coagulation factor Xa (FXa)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/12/2012
Entry Details Article
PubMed
TargetCoagulation factor X(Human)
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50079222({3-(3-Carbamimidoyl-phenyl)-5-[5-(2-sulfamoyl-phen...)
Affinity DataKi:  12nMAssay Description:Binding affinity to purified human coagulation factor Xa (FXa)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/12/2012
Entry Details Article
PubMed
TargetCoagulation factor X(Human)
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50079222({3-(3-Carbamimidoyl-phenyl)-5-[5-(2-sulfamoyl-phen...)
Affinity DataKi:  12nMAssay Description:Binding affinity to purified human coagulation factor Xa (FXa)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/12/2012
Entry Details Article
PubMed
TargetSerine protease 1(Human)
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50079222({3-(3-Carbamimidoyl-phenyl)-5-[5-(2-sulfamoyl-phen...)
Affinity DataKi:  330nMAssay Description:Binding affinity towards trypsin obtained from human purified enzymesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetSerine protease 1(Human)
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50079222({3-(3-Carbamimidoyl-phenyl)-5-[5-(2-sulfamoyl-phen...)
Affinity DataKi:  330nMAssay Description:The binding affinity was measured towards human purified trypsinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/12/2012
Entry Details Article
PubMed
TargetSerine protease 1(Human)
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50079222({3-(3-Carbamimidoyl-phenyl)-5-[5-(2-sulfamoyl-phen...)
Affinity DataKi:  710nMAssay Description:The binding affinity was measured towards human purified trypsinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/12/2012
Entry Details Article
PubMed
TargetSerine protease 1(Human)
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50079222({3-(3-Carbamimidoyl-phenyl)-5-[5-(2-sulfamoyl-phen...)
Affinity DataKi:  710nMAssay Description:The binding affinity was measured towards human purified trypsinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/12/2012
Entry Details Article
PubMed
TargetSerine protease 1(Human)
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50079222({3-(3-Carbamimidoyl-phenyl)-5-[5-(2-sulfamoyl-phen...)
Affinity DataKi:  710nMAssay Description:The binding affinity was measured towards human purified trypsinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/12/2012
Entry Details Article
PubMed
TargetProthrombin(Human)
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50079222({3-(3-Carbamimidoyl-phenyl)-5-[5-(2-sulfamoyl-phen...)
Affinity DataKi:  1.20E+4nMAssay Description:The binding affinity towards thrombin obtained from human purified enzymes.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/12/2012
Entry Details Article
PubMed
TargetProthrombin(Human)
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50079222({3-(3-Carbamimidoyl-phenyl)-5-[5-(2-sulfamoyl-phen...)
Affinity DataKi:  1.20E+4nMAssay Description:The binding affinity towards thrombin obtained from human purified enzymes.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/12/2012
Entry Details Article
PubMed
TargetProthrombin(Human)
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50079222({3-(3-Carbamimidoyl-phenyl)-5-[5-(2-sulfamoyl-phen...)
Affinity DataKi:  1.40E+4nMAssay Description:Binding affinity towards thrombin obtained from human purified enzymesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetProthrombin(Human)
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50079222({3-(3-Carbamimidoyl-phenyl)-5-[5-(2-sulfamoyl-phen...)
Affinity DataKi:  1.40E+4nMAssay Description:The binding affinity towards thrombin obtained from human purified enzymes.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/12/2012
Entry Details Article
PubMed
TargetProthrombin(Human)
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50079222({3-(3-Carbamimidoyl-phenyl)-5-[5-(2-sulfamoyl-phen...)
Affinity DataKi: >2.10E+4nMAssay Description:The binding affinity towards thrombin obtained from human purified enzymes.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/12/2012
Entry Details Article
PubMed