BDBM50335954 CHEMBL1668898::Sodium [2'-[(cyclopropanecarbonyl-ethyl-amino)-methyl]-4'-(6-ethoxy-pyridin-3-yl)-6-methoxy-biphenyl-3-yl]-acetate

SMILES CCOc1ccc(cn1)-c1ccc(c(CN(CC)C(=O)C2CC2)c1)-c1cc(CC([O-])=O)ccc1OC

InChI Key InChIKey=NNHVHOSSHPGFHJ-UHFFFAOYSA-M

Data  18 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 18 hits for monomerid = 50335954   

TargetCytochrome P450 2C9(Human)
Amira Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50335954(Sodium [2'-[(cyclopropanecarbonyl-ethyl-amino)-met...)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of human CYP2C9More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2011
Entry Details Article
PubMed
TargetProstacyclin receptor(Human)
Amira Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50335954(Sodium [2'-[(cyclopropanecarbonyl-ethyl-amino)-met...)
Affinity DataIC50: 1.00E+5nMAssay Description:Displacement of [3H]iloprost from IP receptor in human 293 cell membraneMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2011
Entry Details Article
PubMed
TargetThromboxane A2 receptor(Human)
Amira Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50335954(Sodium [2'-[(cyclopropanecarbonyl-ethyl-amino)-met...)
Affinity DataIC50: 1.00E+5nMAssay Description:Displacement of [3H]SQ-29548 from TP receptor in human platelet membraneMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2011
Entry Details Article
PubMed
TargetProstaglandin D2 receptor(Human)
Amira Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50335954(Sodium [2'-[(cyclopropanecarbonyl-ethyl-amino)-met...)
Affinity DataIC50: 2.67E+4nMAssay Description:Displacement of [3H]PGD2 from DP1 in human platelet membraneMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2011
Entry Details Article
PubMed
TargetPeroxisome proliferator-activated receptor alpha(Human)
Amira Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50335954(Sodium [2'-[(cyclopropanecarbonyl-ethyl-amino)-met...)
Affinity DataIC50: 2.50E+5nMAssay Description:Inhibition of PPAR betaMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2011
Entry Details Article
PubMed
TargetProstaglandin G/H synthase 2(Human)
Amira Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50335954(Sodium [2'-[(cyclopropanecarbonyl-ethyl-amino)-met...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of COX-2More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2011
Entry Details Article
PubMed
TargetCytochrome P450 1A2(Human)
Amira Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50335954(Sodium [2'-[(cyclopropanecarbonyl-ethyl-amino)-met...)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of human CYP1A2More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2011
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Amira Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50335954(Sodium [2'-[(cyclopropanecarbonyl-ethyl-amino)-met...)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of human CYP2D6More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2011
Entry Details Article
PubMed
TargetCytochrome P450 2C19(Human)
Amira Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50335954(Sodium [2'-[(cyclopropanecarbonyl-ethyl-amino)-met...)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of human CYP2C19More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2011
Entry Details Article
PubMed
TargetProstaglandin D2 receptor 2(Human)
Amira Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50335954(Sodium [2'-[(cyclopropanecarbonyl-ethyl-amino)-met...)
Affinity DataIC50: 31nMAssay Description:Displacement of [3H]PGD2 from human CRTh2 receptor expressed in 293 cells by liquid scintillation counting in presence of 0.2 % HSAMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2011
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Amira Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50335954(Sodium [2'-[(cyclopropanecarbonyl-ethyl-amino)-met...)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of human CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2011
Entry Details Article
PubMed
TargetProstaglandin D2 receptor 2(Human)
Amira Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50335954(Sodium [2'-[(cyclopropanecarbonyl-ethyl-amino)-met...)
Affinity DataIC50: 5nMAssay Description:Antagonist activity against CRTh2 receptor in human eosinophils assessed as cell shape change by flow cytometryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2011
Entry Details Article
PubMed
TargetPeroxisome proliferator-activated receptor alpha(Human)
Amira Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50335954(Sodium [2'-[(cyclopropanecarbonyl-ethyl-amino)-met...)
Affinity DataIC50: 2.50E+5nMAssay Description:Inhibition of PPAR alphaMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2011
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Amira Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50335954(Sodium [2'-[(cyclopropanecarbonyl-ethyl-amino)-met...)
Affinity DataIC50: 2nMAssay Description:Inhibition of human CYP3A4 by time-dependent inhibition assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2011
Entry Details Article
PubMed
TargetProstaglandin G/H synthase 1(Human)
Amira Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50335954(Sodium [2'-[(cyclopropanecarbonyl-ethyl-amino)-met...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of COX-1More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2011
Entry Details Article
PubMed
TargetProstaglandin D2 receptor 2(Human)
Amira Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50335954(Sodium [2'-[(cyclopropanecarbonyl-ethyl-amino)-met...)
Affinity DataIC50: 1.70nMAssay Description:Antagonist activity against CRTh2 receptor in human eosinophils assessed as cell shape change after 4 hrs by flow cytometryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2011
Entry Details Article
PubMed
TargetPeroxisome proliferator-activated receptor alpha(Human)
Amira Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50335954(Sodium [2'-[(cyclopropanecarbonyl-ethyl-amino)-met...)
Affinity DataIC50: 2.50E+5nMAssay Description:Inhibition of PPAR gammaMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2011
Entry Details Article
PubMed
TargetProstaglandin D2 receptor 2(Human)
Amira Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50335954(Sodium [2'-[(cyclopropanecarbonyl-ethyl-amino)-met...)
Affinity DataIC50: 6nMAssay Description:Displacement of [3H]PGD2 from human CRTh2 receptor expressed in 293 cells by liquid scintillation countingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2011
Entry Details Article
PubMed