Drug General Information
Drug ID
D02LXI
Former ID
DIB020135
Drug Name
Ki16425
Drug Type
Small molecular drug
Indication Discovery agent Investigative [539925]
Structure
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2D MOL

3D MOL

Formula
C24H25ClN2O5S
InChI
InChI=1S/C24H25ClN2O5S/c1-14-4-9-19(20(25)12-14)16(3)31-24(30)26-22-15(2)27-32-23(22)18-7-5-17(6-8-18)13-33-11-10-21(28)29/h4-9,12,16H,10-11,13H2,1-3H3,(H,26,30)(H,28,29)
InChIKey
NAKZZTXWHXCEPO-UHFFFAOYSA-N
PubChem Compound ID
PubChem Substance ID
Target and Pathway
Target(s) Lysophosphatidic acid receptor Edg-2 Target Info Antagonist [531748]
G protein coupled receptor 87 Target Info Antagonist [529073]
LPA2 receptor Target Info Antagonist [526829]
Lysophosphatidate-3 receptor Target Info Antagonist [526829]
KEGG Pathway Rap1 signaling pathway
Neuroactive ligand-receptor interaction
PI3K-Akt signaling pathway
Gap junction
Pathways in cancerhsa04015:Rap1 signaling pathway
Pathways in cancer
NetPath Pathway TGF_beta_Receptor Signaling Pathway
Pathway Interaction Database LPA receptor mediated eventslysophospholipid_pathway:LPA receptor mediated events
Reactome G alpha (q) signalling events
G alpha (i) signalling events
Lysosphingolipid and LPA receptorsR-HSA-416476:G alpha (q) signalling events
Lysosphingolipid and LPA receptors
WikiPathways Myometrial Relaxation and Contraction Pathways
Gastrin-CREB signalling pathway via PKC and MAPK
Small Ligand GPCRs
GPCR ligand binding
GPCR downstream signalingWP455:GPCRs, Class A Rhodopsin-likeWP2664:Gastrin-CREB signalling pathway via PKC and MAPK
GPCR downstream signaling
References
Ref 539925(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: 2907).
Ref 526829Ki16425, a subtype-selective antagonist for EDG-family lysophosphatidic acid receptors. Mol Pharmacol. 2003 Oct;64(4):994-1005.
Ref 529073The orphan GPCR GPR87 was deorphanized and shown to be a lysophosphatidic acid receptor. Biochem Biophys Res Commun. 2007 Nov 23;363(3):861-6. Epub 2007 Sep 24.
Ref 531748Targeting lysophosphatidic acid receptor type 1 with Debio 0719 inhibits spontaneous metastasis dissemination of breast cancer cells independently of cell proliferation and angiogenesis. Int J Oncol. 2012 Apr;40(4):1133-41.

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