Article
Development of triple mutant T790M/C797S allosteric EGFR inhibitors: a computational approach.
Journal of biomolecular structure & dynamics - 1 Sept 2021
Karnik Kshipra S, Sarkate Aniket P, Lokwani Deepak K, Narula Ishudeep S, Burra Prasad V L S, Wakte Pravin S
Abstract excerpt
The mutations concerned with non-small cell lung cancer involving epidermal growth factor receptor of tyrosine kinase family have primarily targeted. EGFR inhibitors binding allosterically to C797S mutant EGFR enzyme have been developed. Here, database building, library screening performing R-group enumeration and scaffold hopping technique for increasing the EGFR binding affinity of compounds have been carried...
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