20–21 Jan 2022
Birla Institute of Technology
Asia/Kolkata timezone

Design and synthesis of allosteric fourth-generation EGFR tyrosine kinase triple mutant selective inhibitors for the treatment of non-small cell lung cancer

Not scheduled
15m
Birla Institute of Technology

Birla Institute of Technology

Mesra, Ranchi 835 215, Jharkhand, India
Oral Presentation Pharmaceutical Chemistry Oral Presentations

Speaker

Ansari Azim Zakir (Shri Vile Parle Kelavani Mandal’s Institute of Pharmacy, Dhule)

Description

Non-small cell lung cancer (NSCLC) is the leading cause of mortality in oncology, and EGFR-TK plays a critical role in this disease. As a result, EGFR-TK is a viable target for therapeutic development in NSCLC. The T790M EGFR TK mutation was resistant to both first-generation and second-generation (selectivity issue) EGFR TK inhibitors. Although third-generation drugs (Osimertinib) can overcome the EGFR T790M mutation, a recent C797S mutation makes these agents ineffective against it. All of the currently available EGFR kinase inhibitors target the kinase’s highly conserved ATP-site, underlining the need for therapeutics with a different mechanism of action (allosteric binding). EAI001, EAI045, JBJ-04-125-02, DDC4002, and a series of small compounds (fourth generation) having an affinity for the EGFR allosteric site have been discovered and are currently being investigated. To overcome EGFR T790M/C797S resistance, allosteric mutant-selective fourth-generation EGFR inhibitors look to be a promising treatment approach. We present the discovery, development, and structural characterization of allosteric mutant selective EGFR inhibitors based on an anilino pyrimidine scaffold. Our structure-based medicinal chemistry effort resulted in an inhibitor (3) of the EGFR (L858R/T790M) and EGFR (L858R/T790M/C797S) mutants with an IC$_{50}$ of 10 nM and good selectivity, as shown by kinome profiling. Further research into allosteric anilinopyrimidine inhibitors might pave the way for new treatment alternatives for targeting drug-resistant EGFR mutations.

Primary author

Ansari Azim Zakir (Shri Vile Parle Kelavani Mandal’s Institute of Pharmacy, Dhule)

Co-author

Dr Mohd Usman Mohd Siddique (Shri Vile Parle Kelavani Mandal’s Institute of Pharmacy, Dhule)

Presentation materials

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