Drug General Information
Drug ID
D03BRM
Former ID
DIB018916
Drug Name
AUY954
Synonyms
AUY 954
Drug Type
Small molecular drug
Indication Discovery agent Investigative [539942]
Structure
Download
2D MOL
Formula
C25H20F3NO2S
InChI
InChI=1S/C25H20F3NO2S/c26-25(27,28)21-13-18(7-8-20(21)17-4-2-1-3-5-17)23-14-19-12-16(6-9-22(19)32-23)15-29-11-10-24(30)31/h1-9,12-14,29H,10-11,15H2,(H,30,31)
InChIKey
SKYYWSWIUKISCX-UHFFFAOYSA-N
PubChem Compound ID
PubChem Substance ID
Target and Pathway
Target(s) S1P4 receptor Target Info Agonist [528529]
Sphingosine 1-phosphate receptor 1 Target Info Agonist [528529]
Sphingosine 1-phosphate receptor 5 Target Info Agonist [528529]
Sphingosine-1-phosphate receptor-2 Target Info Agonist [528529]
Sphingosine-1-phosphate receptor-3 Target Info Agonist [528528]
KEGG Pathway FoxO signaling pathway
Sphingolipid signaling pathway
Neuroactive ligand-receptor interactionhsa04071:Sphingolipid signaling pathway
Neuroactive ligand-receptor interaction
NetPath Pathway IL4 Signaling Pathway
TGF_beta_Receptor Signaling Pathway
IL2 Signaling Pathway
Pathway Interaction Database Fc-epsilon receptor I signaling in mast cells
S1P3 pathway
S1P1 pathway
Sphingosine 1-phosphate (S1P) pathway
PDGFR-beta signaling pathways1p_s1p4_pathway:S1P4 pathway
S1P5 pathway
Sphingosine 1-phosphate (S1P) pathways1p_s1p3_pathway:S1P3 pathway
S1P2 pathways1p_s1p3_pathway:S1P3 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
Small Ligand GPCRs
GPCR ligand binding
GPCR downstream signaling
GPCRs, OtherWP26:Signal Transduction of S1P Receptor
GPCR downstream signalingWP26:Signal Transduction of S1P Receptor
References
Ref 539942(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: 2925).
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.
Ref 528529A monoselective sphingosine-1-phosphate receptor-1 agonist prevents allograft rejection in a stringent rat heart transplantation model. Chem Biol. 2006 Nov;13(11):1227-34.

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