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PubMed code 14505636

Compile data set for download or QSAR
Found 51 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM50133418
PNG
(CHEMBL423691 | Phosphoric acid mono-((S)-2-amino-2...)
Show SMILES CCCCCCCCCCCCCCNC(=O)[C@@H](N)COP(O)(O)=O
Show InChI InChI=1S/C17H37N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-17(20)16(18)15-24-25(21,22)23/h16H,2-15,18H2,1H3,(H,19,20)(H2,21,22,23)/t16-/m0/s1
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n/an/an/an/a 397n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 1 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM50133423
PNG
(CHEMBL332050 | Phosphoric acid mono-[(S)-2-amino-2...)
Show SMILES CCCCCCCCc1ccc(NC(=O)[C@@H](N)COP(O)(O)=O)cc1
Show InChI InChI=1S/C17H29N2O5P/c1-2-3-4-5-6-7-8-14-9-11-15(12-10-14)19-17(20)16(18)13-24-25(21,22)23/h9-12,16H,2-8,13,18H2,1H3,(H,19,20)(H2,21,22,23)/t16-/m0/s1
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n/an/an/an/a 82n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 1 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM50133425
PNG
(CHEMBL227371 | CHEMBL422074 | Phosphoric acid mono...)
Show SMILES CCCCCCCCc1ccc(NC(=O)[C@H](N)COP(O)(O)=O)cc1
Show InChI InChI=1S/C17H29N2O5P/c1-2-3-4-5-6-7-8-14-9-11-15(12-10-14)19-17(20)16(18)13-24-25(21,22)23/h9-12,16H,2-8,13,18H2,1H3,(H,19,20)(H2,21,22,23)/t16-/m1/s1
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n/an/an/an/a 58n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 1 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))
BDBM50133419
PNG
(CHEMBL114031 | Phosphoric acid mono-[(S)-2-amino-2...)
Show SMILES CCCCCCc1ccc(NC(=O)[C@@H](N)COP(O)(O)=O)cc1
Show InChI InChI=1S/C15H25N2O5P/c1-2-3-4-5-6-12-7-9-13(10-8-12)17-15(18)14(16)11-22-23(19,20)21/h7-10,14H,2-6,11,16H2,1H3,(H,17,18)(H2,19,20,21)/t14-/m0/s1
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n/an/an/an/a 55n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 5 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-Phosphate Receptor 2


(Homo sapiens (Human))
BDBM50133427
PNG
(CHEMBL324358 | Phosphoric acid mono-((S)-2-amino-2...)
Show SMILES CCCCCCCCCCCCNC(=O)[C@@H](N)COP(O)(O)=O
Show InChI InChI=1S/C15H33N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-17-15(18)14(16)13-22-23(19,20)21/h14H,2-13,16H2,1H3,(H,17,18)(H2,19,20,21)/t14-/m0/s1
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n/an/an/an/a 973n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 2 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM50133419
PNG
(CHEMBL114031 | Phosphoric acid mono-[(S)-2-amino-2...)
Show SMILES CCCCCCc1ccc(NC(=O)[C@@H](N)COP(O)(O)=O)cc1
Show InChI InChI=1S/C15H25N2O5P/c1-2-3-4-5-6-12-7-9-13(10-8-12)17-15(18)14(16)11-22-23(19,20)21/h7-10,14H,2-6,11,16H2,1H3,(H,17,18)(H2,19,20,21)/t14-/m0/s1
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n/an/an/an/a 550n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 1 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))
BDBM50133422
PNG
(CHEMBL332472 | Phosphoric acid mono-((R)-2-amino-2...)
Show SMILES CCCCCCCCCCCCCCNC(=O)[C@H](N)COP(O)(O)=O
Show InChI InChI=1S/C17H37N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-17(20)16(18)15-24-25(21,22)23/h16H,2-15,18H2,1H3,(H,19,20)(H2,21,22,23)/t16-/m1/s1
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n/an/an/an/a 50.8n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 3 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-Phosphate Receptor 2


(Homo sapiens (Human))
BDBM50133418
PNG
(CHEMBL423691 | Phosphoric acid mono-((S)-2-amino-2...)
Show SMILES CCCCCCCCCCCCCCNC(=O)[C@@H](N)COP(O)(O)=O
Show InChI InChI=1S/C17H37N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-17(20)16(18)15-24-25(21,22)23/h16H,2-15,18H2,1H3,(H,19,20)(H2,21,22,23)/t16-/m0/s1
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n/an/an/an/a 2.69E+3n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 2 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM50133427
PNG
(CHEMBL324358 | Phosphoric acid mono-((S)-2-amino-2...)
Show SMILES CCCCCCCCCCCCNC(=O)[C@@H](N)COP(O)(O)=O
Show InChI InChI=1S/C15H33N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-17-15(18)14(16)13-22-23(19,20)21/h14H,2-13,16H2,1H3,(H,17,18)(H2,19,20,21)/t14-/m0/s1
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n/an/an/an/a 598n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 1 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM50133426
PNG
(CHEMBL115344 | Phosphoric acid mono-[(R)-2-amino-2...)
Show SMILES CCCCCCc1ccc(NC(=O)[C@H](N)COP(O)(O)=O)cc1
Show InChI InChI=1S/C15H25N2O5P/c1-2-3-4-5-6-12-7-9-13(10-8-12)17-15(18)14(16)11-22-23(19,20)21/h7-10,14H,2-6,11,16H2,1H3,(H,17,18)(H2,19,20,21)/t14-/m1/s1
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n/an/an/an/a 260n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 1 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-Phosphate Receptor 4


(Homo sapiens (Human))
BDBM50133425
PNG
(CHEMBL227371 | CHEMBL422074 | Phosphoric acid mono...)
Show SMILES CCCCCCCCc1ccc(NC(=O)[C@H](N)COP(O)(O)=O)cc1
Show InChI InChI=1S/C17H29N2O5P/c1-2-3-4-5-6-7-8-14-9-11-15(12-10-14)19-17(20)16(18)13-24-25(21,22)23/h9-12,16H,2-8,13,18H2,1H3,(H,19,20)(H2,21,22,23)/t16-/m1/s1
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n/an/an/an/a 500n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 4 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))
BDBM50133423
PNG
(CHEMBL332050 | Phosphoric acid mono-[(S)-2-amino-2...)
Show SMILES CCCCCCCCc1ccc(NC(=O)[C@@H](N)COP(O)(O)=O)cc1
Show InChI InChI=1S/C17H29N2O5P/c1-2-3-4-5-6-7-8-14-9-11-15(12-10-14)19-17(20)16(18)13-24-25(21,22)23/h9-12,16H,2-8,13,18H2,1H3,(H,19,20)(H2,21,22,23)/t16-/m0/s1
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n/an/an/an/a 1.50E+3n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human S1P3 receptor expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))
BDBM50133428
PNG
(CHEMBL325408 | Phosphoric acid mono-((S)-2-amino-2...)
Show SMILES CCCCCCCCCCCCCCCCNC(=O)[C@@H](N)COP(O)(O)=O
Show InChI InChI=1S/C19H41N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-19(22)18(20)17-26-27(23,24)25/h18H,2-17,20H2,1H3,(H,21,22)(H2,23,24,25)/t18-/m0/s1
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n/an/an/an/a 1.22E+3n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 5 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM50158348
PNG
((2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl dihy...)
Show SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@@H](N)COP(O)(O)=O |r|
Show InChI InChI=1S/C18H38NO5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(20)17(19)16-24-25(21,22)23/h14-15,17-18,20H,2-13,16,19H2,1H3,(H2,21,22,23)/b15-14+/t17-,18+/m0/s1
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n/an/an/an/a 0.900n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 1 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand (Experimen...


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-Phosphate Receptor 2


(Homo sapiens (Human))
BDBM50158348
PNG
((2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl dihy...)
Show SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@@H](N)COP(O)(O)=O |r|
Show InChI InChI=1S/C18H38NO5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(20)17(19)16-24-25(21,22)23/h14-15,17-18,20H,2-13,16,19H2,1H3,(H2,21,22,23)/b15-14+/t17-,18+/m0/s1
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n/an/an/an/a 8.30n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 2 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand (Experimen...


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM50158348
PNG
((2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl dihy...)
Show SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@@H](N)COP(O)(O)=O |r|
Show InChI InChI=1S/C18H38NO5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(20)17(19)16-24-25(21,22)23/h14-15,17-18,20H,2-13,16,19H2,1H3,(H2,21,22,23)/b15-14+/t17-,18+/m0/s1
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n/an/an/an/a 4.5n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 1 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand. (Experime...


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-Phosphate Receptor 4


(Homo sapiens (Human))
BDBM50158348
PNG
((2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl dihy...)
Show SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@@H](N)COP(O)(O)=O |r|
Show InChI InChI=1S/C18H38NO5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(20)17(19)16-24-25(21,22)23/h14-15,17-18,20H,2-13,16,19H2,1H3,(H2,21,22,23)/b15-14+/t17-,18+/m0/s1
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n/an/an/an/a 270n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 4 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand (Experimen...


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-Phosphate Receptor 2


(Homo sapiens (Human))
BDBM50133422
PNG
(CHEMBL332472 | Phosphoric acid mono-((R)-2-amino-2...)
Show SMILES CCCCCCCCCCCCCCNC(=O)[C@H](N)COP(O)(O)=O
Show InChI InChI=1S/C17H37N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-17(20)16(18)15-24-25(21,22)23/h16H,2-15,18H2,1H3,(H,19,20)(H2,21,22,23)/t16-/m1/s1
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n/an/an/an/a 2.11E+3n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 2 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))
BDBM50158348
PNG
((2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl dihy...)
Show SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@@H](N)COP(O)(O)=O |r|
Show InChI InChI=1S/C18H38NO5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(20)17(19)16-24-25(21,22)23/h14-15,17-18,20H,2-13,16,19H2,1H3,(H2,21,22,23)/b15-14+/t17-,18+/m0/s1
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n/an/an/an/a 9.20n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 5 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand (Experimen...


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM50133424
PNG
(CHEMBL116953 | Phosphoric acid mono-[(R)-2-amino-2...)
Show SMILES CCCCCCCCCCCCc1ccc(NC(=O)[C@H](N)COP(O)(O)=O)cc1
Show InChI InChI=1S/C21H37N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-18-13-15-19(16-14-18)23-21(24)20(22)17-28-29(25,26)27/h13-16,20H,2-12,17,22H2,1H3,(H,23,24)(H2,25,26,27)/t20-/m1/s1
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n/an/an/an/a 130n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 1 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM50133420
PNG
(CHEMBL115505 | Phosphoric acid mono-((S)-2-amino-2...)
Show SMILES CCCCCCCCCCCCCCONC(=O)[C@@H](N)COP(O)(O)=O
Show InChI InChI=1S/C17H37N2O6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-24-19-17(20)16(18)15-25-26(21,22)23/h16H,2-15,18H2,1H3,(H,19,20)(H2,21,22,23)/t16-/m0/s1
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n/an/an/an/a 322n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 1 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-Phosphate Receptor 4


(Homo sapiens (Human))
BDBM50133417
PNG
(CHEMBL334038 | Phosphoric acid mono-[(R)-2-amino-2...)
Show SMILES CCCCCCCCCCc1ccc(NC(=O)[C@H](N)COP(O)(O)=O)cc1
Show InChI InChI=1S/C19H33N2O5P/c1-2-3-4-5-6-7-8-9-10-16-11-13-17(14-12-16)21-19(22)18(20)15-26-27(23,24)25/h11-14,18H,2-10,15,20H2,1H3,(H,21,22)(H2,23,24,25)/t18-/m1/s1
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n/an/an/an/a 450n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 4 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))
BDBM50133427
PNG
(CHEMBL324358 | Phosphoric acid mono-((S)-2-amino-2...)
Show SMILES CCCCCCCCCCCCNC(=O)[C@@H](N)COP(O)(O)=O
Show InChI InChI=1S/C15H33N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-17-15(18)14(16)13-22-23(19,20)21/h14H,2-13,16H2,1H3,(H,17,18)(H2,19,20,21)/t14-/m0/s1
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n/an/an/an/a 845n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 3 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))
BDBM50133424
PNG
(CHEMBL116953 | Phosphoric acid mono-[(R)-2-amino-2...)
Show SMILES CCCCCCCCCCCCc1ccc(NC(=O)[C@H](N)COP(O)(O)=O)cc1
Show InChI InChI=1S/C21H37N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-18-13-15-19(16-14-18)23-21(24)20(22)17-28-29(25,26)27/h13-16,20H,2-12,17,22H2,1H3,(H,23,24)(H2,25,26,27)/t20-/m1/s1
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n/an/an/an/a 740n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 3 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))
BDBM50133417
PNG
(CHEMBL334038 | Phosphoric acid mono-[(R)-2-amino-2...)
Show SMILES CCCCCCCCCCc1ccc(NC(=O)[C@H](N)COP(O)(O)=O)cc1
Show InChI InChI=1S/C19H33N2O5P/c1-2-3-4-5-6-7-8-9-10-16-11-13-17(14-12-16)21-19(22)18(20)15-26-27(23,24)25/h11-14,18H,2-10,15,20H2,1H3,(H,21,22)(H2,23,24,25)/t18-/m1/s1
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n/an/an/an/a 41n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 5 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))
BDBM50133426
PNG
(CHEMBL115344 | Phosphoric acid mono-[(R)-2-amino-2...)
Show SMILES CCCCCCc1ccc(NC(=O)[C@H](N)COP(O)(O)=O)cc1
Show InChI InChI=1S/C15H25N2O5P/c1-2-3-4-5-6-12-7-9-13(10-8-12)17-15(18)14(16)11-22-23(19,20)21/h7-10,14H,2-6,11,16H2,1H3,(H,17,18)(H2,19,20,21)/t14-/m1/s1
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n/an/an/an/a 43n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 5 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-Phosphate Receptor 2


(Homo sapiens (Human))
BDBM50133428
PNG
(CHEMBL325408 | Phosphoric acid mono-((S)-2-amino-2...)
Show SMILES CCCCCCCCCCCCCCCCNC(=O)[C@@H](N)COP(O)(O)=O
Show InChI InChI=1S/C19H41N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-19(22)18(20)17-26-27(23,24)25/h18H,2-17,20H2,1H3,(H,21,22)(H2,23,24,25)/t18-/m0/s1
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n/an/an/an/a>5.00E+3n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 2 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))
BDBM50158348
PNG
((2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl dihy...)
Show SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@@H](N)COP(O)(O)=O |r|
Show InChI InChI=1S/C18H38NO5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(20)17(19)16-24-25(21,22)23/h14-15,17-18,20H,2-13,16,19H2,1H3,(H2,21,22,23)/b15-14+/t17-,18+/m0/s1
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n/an/an/an/a 44n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 5 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand (Experimen...


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))
BDBM50133418
PNG
(CHEMBL423691 | Phosphoric acid mono-((S)-2-amino-2...)
Show SMILES CCCCCCCCCCCCCCNC(=O)[C@@H](N)COP(O)(O)=O
Show InChI InChI=1S/C17H37N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-17(20)16(18)15-24-25(21,22)23/h16H,2-15,18H2,1H3,(H,19,20)(H2,21,22,23)/t16-/m0/s1
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n/an/an/an/a 1.61E+3n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 5 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-Phosphate Receptor 2


(Homo sapiens (Human))
BDBM50133420
PNG
(CHEMBL115505 | Phosphoric acid mono-((S)-2-amino-2...)
Show SMILES CCCCCCCCCCCCCCONC(=O)[C@@H](N)COP(O)(O)=O
Show InChI InChI=1S/C17H37N2O6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-24-19-17(20)16(18)15-25-26(21,22)23/h16H,2-15,18H2,1H3,(H,19,20)(H2,21,22,23)/t16-/m0/s1
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n/an/an/an/a 2.76E+3n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 2 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))
BDBM50133423
PNG
(CHEMBL332050 | Phosphoric acid mono-[(S)-2-amino-2...)
Show SMILES CCCCCCCCc1ccc(NC(=O)[C@@H](N)COP(O)(O)=O)cc1
Show InChI InChI=1S/C17H29N2O5P/c1-2-3-4-5-6-7-8-14-9-11-15(12-10-14)19-17(20)16(18)13-24-25(21,22)23/h9-12,16H,2-8,13,18H2,1H3,(H,19,20)(H2,21,22,23)/t16-/m0/s1
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n/an/an/an/a 110n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 5 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))
BDBM50133417
PNG
(CHEMBL334038 | Phosphoric acid mono-[(R)-2-amino-2...)
Show SMILES CCCCCCCCCCc1ccc(NC(=O)[C@H](N)COP(O)(O)=O)cc1
Show InChI InChI=1S/C19H33N2O5P/c1-2-3-4-5-6-7-8-9-10-16-11-13-17(14-12-16)21-19(22)18(20)15-26-27(23,24)25/h11-14,18H,2-10,15,20H2,1H3,(H,21,22)(H2,23,24,25)/t18-/m1/s1
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n/an/an/an/a 89n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 3 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-Phosphate Receptor 4


(Homo sapiens (Human))
BDBM50133426
PNG
(CHEMBL115344 | Phosphoric acid mono-[(R)-2-amino-2...)
Show SMILES CCCCCCc1ccc(NC(=O)[C@H](N)COP(O)(O)=O)cc1
Show InChI InChI=1S/C15H25N2O5P/c1-2-3-4-5-6-12-7-9-13(10-8-12)17-15(18)14(16)11-22-23(19,20)21/h7-10,14H,2-6,11,16H2,1H3,(H,17,18)(H2,19,20,21)/t14-/m1/s1
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n/an/an/an/a 880n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 4 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM50133428
PNG
(CHEMBL325408 | Phosphoric acid mono-((S)-2-amino-2...)
Show SMILES CCCCCCCCCCCCCCCCNC(=O)[C@@H](N)COP(O)(O)=O
Show InChI InChI=1S/C19H41N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-19(22)18(20)17-26-27(23,24)25/h18H,2-17,20H2,1H3,(H,21,22)(H2,23,24,25)/t18-/m0/s1
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n/an/an/an/a 1.81E+3n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 1 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM50133417
PNG
(CHEMBL334038 | Phosphoric acid mono-[(R)-2-amino-2...)
Show SMILES CCCCCCCCCCc1ccc(NC(=O)[C@H](N)COP(O)(O)=O)cc1
Show InChI InChI=1S/C19H33N2O5P/c1-2-3-4-5-6-7-8-9-10-16-11-13-17(14-12-16)21-19(22)18(20)15-26-27(23,24)25/h11-14,18H,2-10,15,20H2,1H3,(H,21,22)(H2,23,24,25)/t18-/m1/s1
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n/an/an/an/a 8.60n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 1 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-Phosphate Receptor 2


(Homo sapiens (Human))
BDBM50158348
PNG
((2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl dihy...)
Show SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@@H](N)COP(O)(O)=O |r|
Show InChI InChI=1S/C18H38NO5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(20)17(19)16-24-25(21,22)23/h14-15,17-18,20H,2-13,16,19H2,1H3,(H2,21,22,23)/b15-14+/t17-,18+/m0/s1
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n/an/an/an/a 2.90n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 2 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand (Experimen...


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))
BDBM50158348
PNG
((2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl dihy...)
Show SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@@H](N)COP(O)(O)=O |r|
Show InChI InChI=1S/C18H38NO5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(20)17(19)16-24-25(21,22)23/h14-15,17-18,20H,2-13,16,19H2,1H3,(H2,21,22,23)/b15-14+/t17-,18+/m0/s1
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n/an/an/an/a 8.70n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 3 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand (Experimen...


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))
BDBM50158348
PNG
((2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl dihy...)
Show SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@@H](N)COP(O)(O)=O |r|
Show InChI InChI=1S/C18H38NO5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(20)17(19)16-24-25(21,22)23/h14-15,17-18,20H,2-13,16,19H2,1H3,(H2,21,22,23)/b15-14+/t17-,18+/m0/s1
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n/an/an/an/a 1.10n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 3 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand (Experimen...


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))
BDBM50133422
PNG
(CHEMBL332472 | Phosphoric acid mono-((R)-2-amino-2...)
Show SMILES CCCCCCCCCCCCCCNC(=O)[C@H](N)COP(O)(O)=O
Show InChI InChI=1S/C17H37N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-17(20)16(18)15-24-25(21,22)23/h16H,2-15,18H2,1H3,(H,19,20)(H2,21,22,23)/t16-/m1/s1
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n/an/an/an/a>5.00E+3n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 5 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))
BDBM50133425
PNG
(CHEMBL227371 | CHEMBL422074 | Phosphoric acid mono...)
Show SMILES CCCCCCCCc1ccc(NC(=O)[C@H](N)COP(O)(O)=O)cc1
Show InChI InChI=1S/C17H29N2O5P/c1-2-3-4-5-6-7-8-14-9-11-15(12-10-14)19-17(20)16(18)13-24-25(21,22)23/h9-12,16H,2-8,13,18H2,1H3,(H,19,20)(H2,21,22,23)/t16-/m1/s1
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n/an/an/an/a 450n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 3 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))
BDBM50133420
PNG
(CHEMBL115505 | Phosphoric acid mono-((S)-2-amino-2...)
Show SMILES CCCCCCCCCCCCCCONC(=O)[C@@H](N)COP(O)(O)=O
Show InChI InChI=1S/C17H37N2O6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-24-19-17(20)16(18)15-25-26(21,22)23/h16H,2-15,18H2,1H3,(H,19,20)(H2,21,22,23)/t16-/m0/s1
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n/an/an/an/a 602n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 3 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM50133422
PNG
(CHEMBL332472 | Phosphoric acid mono-((R)-2-amino-2...)
Show SMILES CCCCCCCCCCCCCCNC(=O)[C@H](N)COP(O)(O)=O
Show InChI InChI=1S/C17H37N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-17(20)16(18)15-24-25(21,22)23/h16H,2-15,18H2,1H3,(H,19,20)(H2,21,22,23)/t16-/m1/s1
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n/an/an/an/a 12.7n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 1 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))
BDBM50133420
PNG
(CHEMBL115505 | Phosphoric acid mono-((S)-2-amino-2...)
Show SMILES CCCCCCCCCCCCCCONC(=O)[C@@H](N)COP(O)(O)=O
Show InChI InChI=1S/C17H37N2O6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-24-19-17(20)16(18)15-25-26(21,22)23/h16H,2-15,18H2,1H3,(H,19,20)(H2,21,22,23)/t16-/m0/s1
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n/an/an/an/a>5.00E+3n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 5 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-Phosphate Receptor 4


(Homo sapiens (Human))
BDBM50133424
PNG
(CHEMBL116953 | Phosphoric acid mono-[(R)-2-amino-2...)
Show SMILES CCCCCCCCCCCCc1ccc(NC(=O)[C@H](N)COP(O)(O)=O)cc1
Show InChI InChI=1S/C21H37N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-18-13-15-19(16-14-18)23-21(24)20(22)17-28-29(25,26)27/h13-16,20H,2-12,17,22H2,1H3,(H,23,24)(H2,25,26,27)/t20-/m1/s1
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n/an/an/an/a 1.40E+3n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 4 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))
BDBM50133425
PNG
(CHEMBL227371 | CHEMBL422074 | Phosphoric acid mono...)
Show SMILES CCCCCCCCc1ccc(NC(=O)[C@H](N)COP(O)(O)=O)cc1
Show InChI InChI=1S/C17H29N2O5P/c1-2-3-4-5-6-7-8-14-9-11-15(12-10-14)19-17(20)16(18)13-24-25(21,22)23/h9-12,16H,2-8,13,18H2,1H3,(H,19,20)(H2,21,22,23)/t16-/m1/s1
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n/an/an/an/a 52n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 5 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))
BDBM50133418
PNG
(CHEMBL423691 | Phosphoric acid mono-((S)-2-amino-2...)
Show SMILES CCCCCCCCCCCCCCNC(=O)[C@@H](N)COP(O)(O)=O
Show InChI InChI=1S/C17H37N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-17(20)16(18)15-24-25(21,22)23/h16H,2-15,18H2,1H3,(H,19,20)(H2,21,22,23)/t16-/m0/s1
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n/an/an/an/a 862n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 3 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-Phosphate Receptor 4


(Homo sapiens (Human))
BDBM50133419
PNG
(CHEMBL114031 | Phosphoric acid mono-[(S)-2-amino-2...)
Show SMILES CCCCCCc1ccc(NC(=O)[C@@H](N)COP(O)(O)=O)cc1
Show InChI InChI=1S/C15H25N2O5P/c1-2-3-4-5-6-12-7-9-13(10-8-12)17-15(18)14(16)11-22-23(19,20)21/h7-10,14H,2-6,11,16H2,1H3,(H,17,18)(H2,19,20,21)/t14-/m0/s1
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n/an/an/an/a 1.50E+3n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 4 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-Phosphate Receptor 4


(Homo sapiens (Human))
BDBM50133423
PNG
(CHEMBL332050 | Phosphoric acid mono-[(S)-2-amino-2...)
Show SMILES CCCCCCCCc1ccc(NC(=O)[C@@H](N)COP(O)(O)=O)cc1
Show InChI InChI=1S/C17H29N2O5P/c1-2-3-4-5-6-7-8-14-9-11-15(12-10-14)19-17(20)16(18)13-24-25(21,22)23/h9-12,16H,2-8,13,18H2,1H3,(H,19,20)(H2,21,22,23)/t16-/m0/s1
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n/an/an/an/a 910n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 4 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))
BDBM50133424
PNG
(CHEMBL116953 | Phosphoric acid mono-[(R)-2-amino-2...)
Show SMILES CCCCCCCCCCCCc1ccc(NC(=O)[C@H](N)COP(O)(O)=O)cc1
Show InChI InChI=1S/C21H37N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-18-13-15-19(16-14-18)23-21(24)20(22)17-28-29(25,26)27/h13-16,20H,2-12,17,22H2,1H3,(H,23,24)(H2,25,26,27)/t20-/m1/s1
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n/an/an/an/a 160n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 5 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))
BDBM50133427
PNG
(CHEMBL324358 | Phosphoric acid mono-((S)-2-amino-2...)
Show SMILES CCCCCCCCCCCCNC(=O)[C@@H](N)COP(O)(O)=O
Show InChI InChI=1S/C15H33N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-17-15(18)14(16)13-22-23(19,20)21/h14H,2-13,16H2,1H3,(H,17,18)(H2,19,20,21)/t14-/m0/s1
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n/an/an/an/a 646n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 5 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand; Not deter...


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))
BDBM50133428
PNG
(CHEMBL325408 | Phosphoric acid mono-((S)-2-amino-2...)
Show SMILES CCCCCCCCCCCCCCCCNC(=O)[C@@H](N)COP(O)(O)=O
Show InChI InChI=1S/C19H41N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-19(22)18(20)17-26-27(23,24)25/h18H,2-17,20H2,1H3,(H,21,22)(H2,23,24,25)/t18-/m0/s1
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n/an/an/an/a 879n/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Sphingosine 1-phosphate receptor 3 expressed in HEK293T cells using [gamma-35S]-GTP as radioligand


Bioorg Med Chem Lett 13: 3401-4 (2003)


BindingDB Entry DOI: 10.7270/Q29S1RMW
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%