BDBM50572947 CHEMBL4871014

SMILES C[C@H](N1C2CCC1CC(C2)C(O)=O)c1ccc2ccc(O[C@H]3CC[C@H](CC3)C(F)(F)F)c(c2c1)C(F)(F)F

InChI Key InChIKey=PZASAAIJIFDWSB-BFWXTJNGSA-N

Data  18 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 18 hits for monomerid = 50572947   

LigandPNGBDBM50572947(CHEMBL4871014)
Affinity DataIC50:  1nMAssay Description:Inhibition of human ATX assessed as reduction in LPA formation using FS-3 as substrate preincubated for 30 mins followed by substrate addition and me...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetPotassium voltage-gated channel subfamily H member 2(Homo sapiens (Human))
Biogen

Curated by ChEMBL
LigandPNGBDBM50572947(CHEMBL4871014)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of human ERG by automated patch-clamp assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 1A2(Homo sapiens (Human))
Biogen

Curated by ChEMBL
LigandPNGBDBM50572947(CHEMBL4871014)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of CYP1A2 in human liver microsomes incubated for 15 mins in presence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2C19(Homo sapiens (Human))
Biogen

Curated by ChEMBL
LigandPNGBDBM50572947(CHEMBL4871014)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of CYP2C19 in human liver microsomes incubated for 30 mins in presence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2C9(Homo sapiens (Human))
Biogen

Curated by ChEMBL
LigandPNGBDBM50572947(CHEMBL4871014)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of CYP2C9 in human liver microsomes incubated for 15 mins in presence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2D6(Homo sapiens (Human))
Biogen

Curated by ChEMBL
LigandPNGBDBM50572947(CHEMBL4871014)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of CYP2D6 in human liver microsomes incubated for 15 mins in presence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetLysophosphatidic acid receptor 1(Homo sapiens (Human))
Biogen

Curated by ChEMBL
LigandPNGBDBM50572947(CHEMBL4871014)
Affinity DataIC50:  53nMAssay Description:Inhibition of LPA in human plasma after 18 hrs by LC-MS/MS analysisMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetLysophosphatidic acid receptor 1(Rattus norvegicus)
Biogen

Curated by ChEMBL
LigandPNGBDBM50572947(CHEMBL4871014)
Affinity DataIC50:  47nMAssay Description:Inhibition of LPA in rat plasma after 18 hrs by LC-MS/MS analysisMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSphingosine 1-phosphate receptor 1(Homo sapiens (Human))
Biogen

Curated by ChEMBL
LigandPNGBDBM50572947(CHEMBL4871014)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of S1P1 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSphingosine 1-phosphate receptor 2(Homo sapiens (Human))
Biogen

Curated by ChEMBL
LigandPNGBDBM50572947(CHEMBL4871014)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of S1P2 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSphingosine 1-phosphate receptor 3(Homo sapiens (Human))
Biogen

Curated by ChEMBL
LigandPNGBDBM50572947(CHEMBL4871014)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of S1P3 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSphingosine 1-phosphate receptor 4(Homo sapiens (Human))
Biogen

Curated by ChEMBL
LigandPNGBDBM50572947(CHEMBL4871014)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of S1P4 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSphingosine 1-phosphate receptor 5(Homo sapiens (Human))
Biogen

Curated by ChEMBL
LigandPNGBDBM50572947(CHEMBL4871014)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of S1P5 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetLysophosphatidic acid receptor 1(Homo sapiens (Human))
Biogen

Curated by ChEMBL
LigandPNGBDBM50572947(CHEMBL4871014)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of LPA1 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetLysophosphatidic acid receptor 2(Homo sapiens)
Biogen

Curated by ChEMBL
LigandPNGBDBM50572947(CHEMBL4871014)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of LPA2 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
Biogen

Curated by ChEMBL
LigandPNGBDBM50572947(CHEMBL4871014)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of LPA3 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetLysophosphatidic acid receptor 5(Homo sapiens (Human))
Biogen

Curated by ChEMBL
LigandPNGBDBM50572947(CHEMBL4871014)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of LPA5 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 3A4(Homo sapiens (Human))
Biogen

Curated by ChEMBL
LigandPNGBDBM50572947(CHEMBL4871014)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of CYP3A4 in human liver microsomes incubated for 15 mins in presence of NADPH by LC-MS/MS analysisMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed