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Development of chemical tools to study intracellular cannabinoid  type 2 receptor
Doctoral Thesis   Open access

Development of chemical tools to study intracellular cannabinoid type 2 receptor

Jiazhen Yin
Doctor of Philosophy - PhD, University of Otago
University of Otago
2022
Handle:
https://hdl.handle.net/10523/13656

Abstract

CB2R Photo-activated Enzyme-cleavable Prodrugs
There are increasing numbers of reports that G protein-coupled receptors (GPCRs) can signal from intracellular locations. Cannabinoid type 2 receptor (CB2R), a Class A GPCR, is a promising target to treat pain, inflammation, cancer, and rheumatoid arthritis. CB2R is an example of a GPCR that has considerable intracellular expression which has been suggested to elicit unique signal transduction pathways in comparison with surface-resident CB2R. This research aims to design, synthesise and evaluate a series of novel tool compounds which can specifically target intracellular CB2R. To realise the specific intracellular CB2R targeting, chemical tools were designed as prodrugs of a CB2R agonist, which could either be activated by an intracellularly expressed luciferase (and luciferin) via a bioluminescence resonance energy transfer (BRET) process or could be activated by an intracellular enzyme such as cathepsin B. A photo-activated CB2R agonist prodrug (2.2) and two photo-activated model prodrugs (2.4 and 2.5) were designed, synthesised and evaluated. All three photo-activated prodrugs were tested under LED light and the results were analysed by analytical RP-HPLC and LC-MS. Although the investigation of photolysis illustrated the reaction mechanisms were different in organic and aqueous solutions, all three prodrugs showed promising photolysis profiles under the LED light. The photo-activated CB2R agonist prodrug 2.2 had the fastest cleavage at 450-455 nm blue LED light, which matched the design specification. The photo-activated CB2R agonist prodrug 2.2 will likely prove a very useful prodrug to study CB2R in a triggered way using artificial light. Biological evaluation of prodrug 2.2 is currently being undertaken in Auckland by collaborators. Unfortunately, the initial attempt of BRET-triggered cleavage on the photo-activated CB2R agonist prodrug 2.2 by the untemplated luciferin and luciferase failed. The overall original idea was to template the prodrug to the luciferin. However, this was not completed due to time constraints. The results of this thesis show that a templated prodrug is an absolute requirement for successful BRET and prodrug cleavage. A series of cathepsin B cleavable CB2R agonist prodrugs were also designed, synthesised and evaluated as another intracellular CB2R targeting strategy. The cathepsin B enzymatic cleavage on model prodrugs 4.11, 4.12, 4.13, 4.24 and prodrugs 4.1, 4.17, 4.18, 4.25 were monitored by analytical RP-HPLC and LC-MS. Although some of the model prodrugs (4.13 and 4.24) showed possible cleavage after incubation with cathepsin B, none of the prodrugs which released CB2R agonists were successfully cleaved in vitro. The results suggested that the steric hinderance caused by the CB2R agonist was the problem, which could be solved in future work by using other less bulky CB2R agonists.
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