Drug Information

Drug General Information
Drug ID
D06GFH
Former ID
DIB021167
Drug Name
VPC44116
Synonyms
VPC-44116
Drug Type
Small molecular drug
Indication Discovery agent Investigative [539948]
Structure
Download
2D MOL
Formula
C18H31N2O4P
InChI
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
InChIKey
FMLHSOGKNHADEE-QGZVFWFLSA-N
PubChem Compound ID
11545181
PubChem Substance ID
16647370, 23667979, 42663191, 74904877, 103515382, 104079655, 135651310, 137593403, 237897651, 247279991
Target and Pathway
Target(s) Sphingosine 1-phosphate receptor 5 Target Info Agonist [528528]
Sphingosine-1-phosphate receptor-3 Target Info Antagonist [528528]
Sphingosine 1-phosphate receptor 1 Target Info Antagonist [528528]
KEGG Pathway Sphingolipid signaling pathway
Neuroactive ligand-receptor interactionhsa04071:Sphingolipid signaling pathway
Neuroactive ligand-receptor interactionhsa04068:FoxO signaling pathway
Neuroactive ligand-receptor interaction
NetPath Pathway IL4 Signaling Pathway
TGF_beta_Receptor Signaling Pathway
IL2 Signaling Pathway
Pathway Interaction Database S1P4 pathway
S1P5 pathway
Sphingosine 1-phosphate (S1P) pathways1p_s1p3_pathway:S1P3 pathway
Sphingosine 1-phosphate (S1P) pathwayfcer1pathway:Fc-epsilon receptor I signaling in mast cells
S1P3 pathway
S1P1 pathway
Sphingosine 1-phosphate (S1P) pathway
PDGFR-beta signaling pathway
Reactome G alpha (i) signalling events
Lysosphingolipid and LPA receptorsR-HSA-418594:G alpha (i) signalling events
Lysosphingolipid and LPA receptors
WikiPathways Signal Transduction of S1P Receptor
GPCR ligand binding
GPCR downstream signalingWP26:Signal Transduction of S1P Receptor
Small Ligand GPCRs
GPCR downstream signaling
GPCRs, Other
References
Ref 539948(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 528528Synthesis 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. Epub2006 Nov 1.

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