TTD | Drug: D04XCB

Drug General Information
Drug ID	D04XCB
Former ID	DNC004313
Drug Name	3-amino-5-(4-octylphenyl)pentanoic acid
Drug Type	Small molecular drug
Indication	Discovery agent		Investigative	[530721]
Structure		Download 2D MOL 3D MOL
Formula	C19H31NO2
Canonical SMILES	CCCCCCCCC1=CC=C(C=C1)CCC(CC(=O)O)N
InChI	1S/C19H31NO2/c1-2-3-4-5-6-7-8-16-9-11-17(12-10-16)13-14-18(20)15-19(21)22/h9-12,18H,2-8,13-15,20H2,1H3,(H,21,22)
InChIKey	UDEAYIGFOWYIGY-UHFFFAOYSA-N
PubChem Compound ID	10149595
Target and Pathway
Target(s)	Sphingosine 1-phosphate receptor 1	Target Info	Inhibitor	[530721]
KEGG Pathway	FoxO signaling pathway
	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 pathway
Reactome	G alpha (i) signalling events
Reactome	Lysosphingolipid and LPA receptors
WikiPathways	Signal Transduction of S1P Receptor
	Small Ligand GPCRs
	GPCR ligand binding
	GPCR downstream signaling
	GPCRs, Other
References
Ref 530721	Bioorg Med Chem Lett. 2010 Mar 1;20(5):1485-7. Epub 2010 Jan 28.S1P receptor mediated activity of FTY720 phosphate mimics.
Ref 530721	Bioorg Med Chem Lett. 2010 Mar 1;20(5):1485-7. Epub 2010 Jan 28.S1P receptor mediated activity of FTY720 phosphate mimics.

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Drug Information