BDBM12775 2-(5-carbamimidoyl-1H-indol-3-yl)-N-[4-(2-sulfamoylphenyl)phenyl]acetamide::5-amidinoindole 1::CHEMBL136846

SMILES NC(=N)c1ccc2[nH]cc(CC(=O)Nc3ccc(cc3)-c3ccccc3S(N)(=O)=O)c2c1

InChI Key InChIKey=HTUXSSSIXKJFED-UHFFFAOYSA-N

Data  7 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 12775   

TargetCoagulation factor X(Human)
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM12775(CHEMBL136846 | 2-(5-carbamimidoyl-1H-indol-3-yl)-N...)
Affinity DataKi:  2.10nMAssay Description:Binding affinity against human coagulation factor XMore 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
LigandPNGBDBM12775(CHEMBL136846 | 2-(5-carbamimidoyl-1H-indol-3-yl)-N...)
Affinity DataKi:  3.20nM ΔG°:  -11.5kcal/molepH: 7.0 T: 2°CAssay Description:Ki values were obtained from human purified enzyme. All assays were run in microtiter plates. Plates were read for 30 min at 405 nm. Rates were deter...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/1/2007
Entry Details Article
PubMed
TargetCoagulation factor X(Human)
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM12775(CHEMBL136846 | 2-(5-carbamimidoyl-1H-indol-3-yl)-N...)
Affinity DataKi:  6nMAssay Description:Binding affinity against fXa from rabbit purified enzymeMore 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
LigandPNGBDBM12775(CHEMBL136846 | 2-(5-carbamimidoyl-1H-indol-3-yl)-N...)
Affinity DataKi:  160nMAssay Description:Binding affinity against human trypsinMore 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
LigandPNGBDBM12775(CHEMBL136846 | 2-(5-carbamimidoyl-1H-indol-3-yl)-N...)
Affinity DataKi:  1.60E+3nMAssay Description:Binding affinity against human thrombinMore 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
LigandPNGBDBM12775(CHEMBL136846 | 2-(5-carbamimidoyl-1H-indol-3-yl)-N...)
Affinity DataKi:  1.60E+3nMAssay Description:Binding affinity against human thrombinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetCoagulation factor IX(Human)
Bristol-Myers Squibb

LigandPNGBDBM12775(CHEMBL136846 | 2-(5-carbamimidoyl-1H-indol-3-yl)-N...)
Affinity DataKi:  6.70E+3nMAssay Description:Ki values were obtained from human purified enzyme. All assays were run in microtiter plates. Plates were read for 30 min at 405 nm. Rates were deter...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/1/2007
Entry Details Article
PubMed