Drug Information

Drug General Information
Drug ID
D02IBM
Former ID
DNC004568
Drug Name
SQ-29548
Drug Type
Small molecular drug
Indication Discovery agent Terminated [539277], [545003]
Structure
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2D MOL

3D MOL
Formula
C21H29N3O4
InChI
InChI=1S/C21H29N3O4/c25-20(26)11-7-2-1-6-10-16-17(19-13-12-18(16)28-19)14-22-24-21(27)23-15-8-4-3-5-9-15/h1,3-6,8-9,16-19,22H,2,7,10-14H2,(H,25,26)(H2,23,24,27)/b6-1-/t16-,17+,18-,19+/m1/s1
InChIKey
RJNDVCNWVBWHLY-OQMICVBCSA-N
PubChem Compound ID
6437074
PubChem Substance ID
39341122, 53787742, 57367833, 80342077, 135270022, 135651068, 135651207
Target and Pathway
Target(s) Thromboxane A2 receptor Target Info Inhibitor [529310]
KEGG Pathway Calcium signaling pathway
Neuroactive ligand-receptor interaction
Platelet activation
Reactome Prostanoid ligand receptors
G alpha (q) signalling events
G alpha (12/13) signalling events
Thromboxane signalling through TP receptor
WikiPathways GPCRs, Class A Rhodopsin-like
Gastrin-CREB signalling pathway via PKC and MAPK
Small Ligand GPCRs
Signal amplification
GPCR ligand binding
GPCR downstream signaling
References
Ref 539277(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: 1980).
Ref 545003Trusted, scientifically sound profiles of drug programs, clinical trials, safety reports, and company deals, written by scientists. Springer. 2015. Adis Insight (drug id 800001848)
Ref 529310J Med Chem. 1991 Apr;34(4):1511-4.Novel synthesis and biochemical properties of an [125I]-labeled photoaffinity probe for thromboxane A2/prostaglandin H2 receptors.

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