Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D06GFH
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| Former ID |
DIB021167
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| Drug Name |
VPC44116
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| Synonyms |
VPC-44116
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
| Structure |
 |
Download2D MOL
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| Formula |
C18H31N2O4P
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| Canonical SMILES |
CCCCCCCCC1=CC(=CC=C1)NC(=O)C(CCP(=O)(O)O)N
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| InChI |
1S/C18H31N2O4P/c1-2-3-4-5-6-7-9-15-10-8-11-16(14-15)20-18(21)17(19)12-13-25(22,23)24/h8,10-11,14,17H,2-7,9,12-13,19H2,1H3,(H,20,21)(H2,22,23,24)/t17-/m1/s1
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| InChIKey |
FMLHSOGKNHADEE-QGZVFWFLSA-N
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| PubChem Compound ID | ||||
| PubChem Substance ID | ||||
| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Sphingosine-1-phosphate receptor 1 (S1PR1) | Target Info | Antagonist | [2] |
| Sphingosine-1-phosphate receptor 3 (S1PR3) | Target Info | Antagonist | [2] | |
| Sphingosine-1-phosphate receptor 5 (S1PR5) | Target Info | Agonist | [2] | |
| KEGG Pathway | Sphingolipid signaling pathway | |||
| Neuroactive ligand-receptor interaction | ||||
| FoxO signaling pathway | ||||
| NetPath Pathway | IL4 Signaling Pathway | |||
| TGF_beta_Receptor Signaling Pathway | ||||
| IL2 Signaling Pathway | ||||
| Pathway Interaction Database | S1P4 pathway | |||
| S1P5 pathway | ||||
| Sphingosine 1-phosphate (S1P) pathway | ||||
| S1P3 pathway | ||||
| Fc-epsilon receptor I signaling in mast cells | ||||
| S1P1 pathway | ||||
| PDGFR-beta signaling pathway | ||||
| Reactome | G alpha (i) signalling events | |||
| Lysosphingolipid and LPA receptors | ||||
| WikiPathways | Signal Transduction of S1P Receptor | |||
| GPCR ligand binding | ||||
| GPCR downstream signaling | ||||
| Small Ligand GPCRs | ||||
| GPCRs, Other | ||||
| References | Top | |||
|---|---|---|---|---|
| REF 1 | URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 2930). | |||
| REF 2 | Synthesis and biological evaluation of gamma-aminophosphonates as potent, subtype-selective sphingosine 1-phosphate receptor agonists and antagonists. Bioorg Med Chem. 2007 Jan 15;15(2):663-77. | |||
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