siponimod [Ligand Id: 9289] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL2336071 (Baf312, BAF312, BAF-312, NVP-BAF312-NX, Siponimod)
  • 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/Sphingosine 1-phosphate receptor Edg-6 in Human [ChEMBL: CHEMBL3230] [GtoPdb: 278] [UniProtKB: O95977]
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  • S1P5 receptor/Sphingosine 1-phosphate receptor Edg-8 in Human [ChEMBL: CHEMBL2274] [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 Agonist activity at human S1P1 receptor transfected in CHO cells incubated for 10 to 15 mins prior to GTPgamma35S addition measured after 120 mins by GTPgamma35S binding assay F 9.4 pEC50 0.4 nM EC50 ACS Med Chem Lett (2013) 4: 333-337 [PMID:24900670]
GtoPdb In a GTPγS binding assay - 9.4 pEC50 0.4 nM EC50 ACS Med Chem Lett (2013) 4: 333-7 [PMID:24900670];
Drug Metab Dispos (2018) 46: 1001-1013 [PMID:29735753]
GtoPdb - - 10.11 pEC50 0.08 nM EC50 PLoS One (2019) 14: e0226154 [PMID:31805144]
S1P3 receptor/Sphingosine 1-phosphate receptor Edg-3 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3892] [GtoPdb: 277] [UniProtKB: Q99500]
GtoPdb In a GTPγS binding assay - 5.3 pEC50 5000 nM EC50 ACS Med Chem Lett (2013) 4: 333-7 [PMID:24900670]
ChEMBL Agonist activity at human S1P3 receptor transfected in CHO cells incubated for 10 to 15 mins prior to GTPgamma35S addition measured after 120 mins by GTPgamma35S binding assay F 5.3 pEC50 5000 nM EC50 ACS Med Chem Lett (2013) 4: 333-337 [PMID:24900670]
S1P4 receptor/Sphingosine 1-phosphate receptor Edg-6 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3230] [GtoPdb: 278] [UniProtKB: O95977]
GtoPdb In a GTPγS binding assay - 6.12 pEC50 750 nM EC50 Bioorg Med Chem Lett (2013) 23: 6377-89 [PMID:24125884]
ChEMBL Agonist activity at human S1P4 receptor expressed in CHO cells by [35S]GTPgammaS binding assay F 6.12 pEC50 750 nM EC50 Bioorg Med Chem Lett (2013) 23: 6377-6389 [PMID:24125884]
S1P5 receptor/Sphingosine 1-phosphate receptor Edg-8 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2274] [GtoPdb: 279] [UniProtKB: Q9H228]
ChEMBL Agonist activity at human S1P5 receptor expressed in CHO cells by [35S]GTPgammaS binding assay F 9.01 pEC50 0.98 nM EC50 Bioorg Med Chem Lett (2013) 23: 6377-6389 [PMID:24125884]
GtoPdb In a GTPγS binding assay - 9.01 pEC50 0.98 nM EC50 Bioorg Med Chem Lett (2013) 23: 6377-89 [PMID:24125884];
Br J Pharmacol (2012) 167: 1035-47 [PMID:22646698];
Nurs Times (1998) 94: 55-7 [PMID:9735753]

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]