null

SMILES C[C@](N)(COP(O)(O)=O)c1nc(c[nH]1)-c1ccc(OCc2ccc(cc2)-c2ccccc2)cc1

InChI Key InChIKey=KVYQKSXTMZHEPB-VWLOTQADSA-N

  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 12 hits for monomerid = 50249266   

TargetSphingosine 1-phosphate receptor 1(Homo sapiens (Human))
Praecis Pharmaceuticals Inc

Curated by ChEMBL
LigandPNGBDBM50249266((R)-2-amino-2-(4-(4-(biphenyl-4-ylmethoxy)phenyl)-...)copy SMILEScopy InChI
Affinity DataIC50: 1.03nMAssay Description:Displacement of [33P]sphingosine-1-phosphate from human S1P1 receptorMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XD11KJPubMed
TargetSphingosine 1-phosphate receptor 3(Homo sapiens (Human))
Praecis Pharmaceuticals Inc

Curated by ChEMBL
LigandPNGBDBM50249266((R)-2-amino-2-(4-(4-(biphenyl-4-ylmethoxy)phenyl)-...)copy SMILEScopy InChI
Affinity DataIC50: 20nMAssay Description:Displacement of [33P]sphingosine-1-phosphate from human S1P3 receptorMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XD11KJPubMed
TargetSphingosine 1-phosphate receptor 1(Homo sapiens (Human))
Praecis Pharmaceuticals Inc

Curated by ChEMBL
LigandPNGBDBM50249266((R)-2-amino-2-(4-(4-(biphenyl-4-ylmethoxy)phenyl)-...)copy SMILEScopy InChI
Affinity DataEC50:  37.2nMAssay Description:Agonist activity at human S1P1 receptor assessed as stimulation of [35S]GTPgammaS bindingMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XD11KJPubMed
TargetSphingosine 1-phosphate receptor 3(Homo sapiens (Human))
Praecis Pharmaceuticals Inc

Curated by ChEMBL
LigandPNGBDBM50249266((R)-2-amino-2-(4-(4-(biphenyl-4-ylmethoxy)phenyl)-...)copy SMILEScopy InChI
Affinity DataEC50: >3.00E+3nMAssay Description:Agonist activity at human S1P3 receptor assessed as stimulation of [35S]GTPgammaS bindingMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XD11KJPubMed
TargetSphingosine 1-phosphate receptor 4(Homo sapiens (Human))
Praecis Pharmaceuticals Inc

Curated by ChEMBL
LigandPNGBDBM50249266((R)-2-amino-2-(4-(4-(biphenyl-4-ylmethoxy)phenyl)-...)copy SMILEScopy InChI
Affinity DataIC50: 4.90nMAssay Description:Displacement of [33P]sphingosine-1-phosphate from human S1P4 receptorMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XD11KJPubMed
TargetSphingosine 1-phosphate receptor 3(Homo sapiens (Human))
Praecis Pharmaceuticals Inc

Curated by ChEMBL
LigandPNGBDBM50249266((R)-2-amino-2-(4-(4-(biphenyl-4-ylmethoxy)phenyl)-...)copy SMILEScopy InChI
Affinity DataEC50:  54.8nMAssay Description:Antagonist activity at human S1P3 receptor expressed in HEK293T cells assessed as inhibition of sphingosine-1-phosphate-induced gamma-[35S]GTP bindin...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XS5VJBPubMed
TargetSphingosine 1-phosphate receptor 1(Homo sapiens (Human))
Praecis Pharmaceuticals Inc

Curated by ChEMBL
LigandPNGBDBM50249266((R)-2-amino-2-(4-(4-(biphenyl-4-ylmethoxy)phenyl)-...)copy SMILEScopy InChI
Affinity DataIC50: 1.03nMAssay Description:Displacement of [33P]sphingosine-1-phosphate from human S1P1 receptor expressed in HEK293T cells after 60 mins by scintillation countingMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XS5VJBPubMed
TargetSphingosine 1-phosphate receptor 3(Homo sapiens (Human))
Praecis Pharmaceuticals Inc

Curated by ChEMBL
LigandPNGBDBM50249266((R)-2-amino-2-(4-(4-(biphenyl-4-ylmethoxy)phenyl)-...)copy SMILEScopy InChI
Affinity DataIC50: 20nMAssay Description:Displacement of [33P]sphingosine-1-phosphate from human S1P3 receptor expressed in HEK293T cells after 60 mins by scintillation countingMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XS5VJBPubMed
TargetSphingosine 1-phosphate receptor 4(Homo sapiens (Human))
Praecis Pharmaceuticals Inc

Curated by ChEMBL
LigandPNGBDBM50249266((R)-2-amino-2-(4-(4-(biphenyl-4-ylmethoxy)phenyl)-...)copy SMILEScopy InChI
Affinity DataIC50: 4.87nMAssay Description:Displacement of [33P]sphingosine-1-phosphate from human S1P4 receptor expressed in HEK293T cells after 60 mins by scintillation countingMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XS5VJBPubMed
TargetSphingosine 1-phosphate receptor 5(Homo sapiens (Human))
Praecis Pharmaceuticals Inc

Curated by ChEMBL
LigandPNGBDBM50249266((R)-2-amino-2-(4-(4-(biphenyl-4-ylmethoxy)phenyl)-...)copy SMILEScopy InChI
Affinity DataIC50: 9.60nMAssay Description:Displacement of [33P]sphingosine-1-phosphate from human S1P5 receptor expressed in HEK293T cells after 60 mins by scintillation countingMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XS5VJBPubMed
TargetSphingosine 1-phosphate receptor 1(Homo sapiens (Human))
Praecis Pharmaceuticals Inc

Curated by ChEMBL
LigandPNGBDBM50249266((R)-2-amino-2-(4-(4-(biphenyl-4-ylmethoxy)phenyl)-...)copy SMILEScopy InChI
Affinity DataEC50:  2.20nMAssay Description:Antagonist activity at human S1P1 receptor expressed in HEK293T cells assessed as inhibition of sphingosine-1-phosphate-induced gamma-[35S]GTP bindin...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XS5VJBPubMed
TargetSphingosine 1-phosphate receptor 5(Homo sapiens (Human))
Praecis Pharmaceuticals Inc

Curated by ChEMBL
LigandPNGBDBM50249266((R)-2-amino-2-(4-(4-(biphenyl-4-ylmethoxy)phenyl)-...)copy SMILEScopy InChI
Affinity DataIC50: 9.60nMAssay Description:Displacement of [33P]sphingosine-1-phosphate from human S1P5 receptorMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XD11KJPubMed