ponesimod [Ligand Id: 9320] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL1096146 (ACT-128800, Ponesimod, Ponvory)
  • S1P1 receptor/Sphingosine 1-phosphate receptor Edg-1 in Human [ChEMBL: CHEMBL4333] [GtoPdb: 275] [UniProtKB: P21453]
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  • S1P3 receptor/Sphingosine 1-phosphate receptor Edg-3 in Human [ChEMBL: CHEMBL3892] [GtoPdb: 277] [UniProtKB: Q99500]
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  • S1P4 receptor in Human [GtoPdb: 278] [UniProtKB: O95977]
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  • S1P5 receptor in Human [GtoPdb: 279] [UniProtKB: Q9H228]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
S1P1 receptor/Sphingosine 1-phosphate receptor Edg-1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4333] [GtoPdb: 275] [UniProtKB: P21453]
ChEMBL Inhibition of S1PR1 (unknown origin) expressed in CHOK1 cells after 90 mins by beta-arresting recuitment assay F 7.9 pIC50 12.59 nM IC50 Bioorg Med Chem Lett (2018) 28: 3255-3259 [PMID:30143424]
ChEMBL Agonist activity at human recombinant S1P1 receptor expressed in CHO cells by GTPgammaS binding assay F 8.01 pEC50 9.7 nM EC50 J Med Chem (2010) 53: 4198-4211 [PMID:20446681]
GtoPdb In a radioligand binding assay using membranes from CHO cells expressing human S1P1 - 8.04 pEC50 9.1 nM EC50 J Med Chem (2010) 53: 4198-211 [PMID:20446681]
S1P3 receptor/Sphingosine 1-phosphate receptor Edg-3 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3892] [GtoPdb: 277] [UniProtKB: Q99500]
GtoPdb In a radioligand binding assay using membranes from CHO cells expressing human S1P2 - 5.68 pIC50 2068 nM IC50 J Med Chem (2010) 53: 4198-211 [PMID:20446681]
ChEMBL Agonist activity at human recombinant S1P3 receptor expressed in CHO cells by GTPgammaS binding assay F 6.96 pEC50 109 nM EC50 J Med Chem (2010) 53: 4198-4211 [PMID:20446681]
S1P4 receptor in Human [GtoPdb: 278] [UniProtKB: O95977]
GtoPdb In a radioligand binding assay using membranes from CHO cells expressing human S1P4 - 5.71 pIC50 1956 nM IC50 J Med Chem (2010) 53: 4198-211 [PMID:20446681]
S1P5 receptor in Human [GtoPdb: 279] [UniProtKB: Q9H228]
GtoPdb In a radioligand binding assay using membranes from CHO cells expressing human S1P5 - 6.85 pIC50 142 nM IC50 J Med Chem (2010) 53: 4198-211 [PMID:20446681]

ChEMBL data shown on this page come from version 32:

Mendez D, Gaulton A, Bento AP, Chambers J, De Veij M, Félix E, Magariños MP, Mosquera JF, Mutowo P, Nowotka M, Gordillo-Marañón M, Hunter F, Junco L, Mugumbate G, Rodriguez-Lopez M, Atkinson F, Bosc N, Radoux CJ, Segura-Cabrera A, Hersey A, Leach AR. (2019) 'ChEMBL: towards direct deposition of bioassay data' Nucleic Acids Res., 47(D1). DOI: 10.1093/nar/gky1075. [EPMCID:30398643]
Davies M, Nowotka M, Papadatos G, Dedman N, Gaulton A, Atkinson F, Bellis L, Overington JP. (2015) 'ChEMBL web services: streamlining access to drug discovery data and utilities.' Nucleic Acids Res., 43(W1). DOI: 10.1093/nar/gkv352. [EPMCID:25883136]