Exploring Novel Coumarin‐Tethered Bis‐Triazoles: Apoptosis Induction in Human Pancreatic Cancer Cells, Antimicrobial Effects, and Molecular Modelling Investigations

Author:

Dhawan Sanjeev1,Singh Ashona1,Manhas Neha1,Seboletswe Pule1,Khubone Lungisani1,Kumar Gobind1,Jonnalagadda Sreekantha B.1,Raza Asif2,Sharma Arun K.2,Singh Parvesh1ORCID

Affiliation:

1. School of Chemistry and Physics University of KwaZulu-Natal P/Bag X54001, Westville Durban 4000 South Africa

2. Department of Pharmacology Penn State College of Medicine Penn State Cancer Institute, CH72 500 University Drive Hershey PA 17033 USA

Abstract

AbstractIn the present study, we identified that two representative compounds (7 c and 9 f) of our newly synthesized coumarin‐tagged bis‐triazoles induced apoptosis in human pancreatic cells (PANC‐1) by caspase 3/7mediated pathway. Both 7 c and 9 f (IC50=7.15±1.19 and 6.09±0.79 μM, respectively) were found to be ~100 times superior against PANC‐1 as compared to the standard drug Gemcitabine (IC50=>500 μM), without showing any toxicity to the normal pancreatic epithelial cells (H6C7). Molecular docking studies further endorsed them as potential pancreatic cancer therapeutics due to their strong hydrogen bonding interactions with the epidermal growth factor receptor (EGFR) enzyme, which is overexpressed in cancerous cells including pancreatic cancer. Additionally, these compounds also showed moderate inhibitory activity against a panel of microbial strains. Overall, our findings reveal that the coumarin hybrids 7 c and 9 f are viable chemotypes to be adopted as templates for the development of new anticancer drugs, particularly against pancreatic cancer.

Publisher

Wiley

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