In silico evaluation of Syzygium cumini phytochemicals as BCL-2 inhibitors: molecular docking and molecular dynamics simulations for gastric cancer therapy
Findings provide mechanistic insights into the potential modulation of S. cumini phytochemicals and BCL-2 inhibitors and support further experimental validation as apoptosis-inducing candidates against gastric cancer.
Computational predictions of potential interactions between selected cinnamon-derived phytochemicals and cancer-associated signaling proteins are provided and are consistent with the preliminary observation that the crude cinnamon extract exhibits antioxidant activity and cytotoxic effects in colorectal cancer cell lin...
R. Raut, S. Anwar, Reem Alromaihi et al.· Current Issues in Molecular...· 0 citations
The results suggest that A. cardamomum could serve as a potential source for developing new plant-based therapies against breast cancer and further in vitro and in vivo investigations are warranted to validate their efficacy and safety.
Dessy Arisanty, S. Khairani, K. Cuandra et al.· F1000Research· 0 citations
The phytochemical profile and therapeutic potential of Pleurotus membranaceus against lung cancer-associated targets were evaluated and ergosterol derived from Pleurotus membranaceus may represent a promising natural bioactive compound for further investigation as a potential therapeutic candidate against lung cancer.
Saba Ehsan, Divya Mishra, Anupriya Chaudhary et al.· Discover Chemistry· 0 citations
Tryptophenolide (Lei4) showed moderate but reproducible anti-CRC activity and directly inhibited EGFR kinase activity in vitro, supporting EGFR pathway inhibition as one mechanism contributing to its cellular effects.
Qian Gu, Shi-Lei Zhao, Xin Zhang et al.· Journal of Computer-Aided Mo...· 0 citations
This comprehensive study elucidates the therapeutic efficacy of C. paniculatus in combating lung cancer, thereby facilitating the development of potent anti-cancer interventions.
Jyoti Kumari, R. V.· Journal of Pharmaceutical In...· 0 citations
The study provides a scientific basis for the development of novel plant-derived therapeutic agents and highlights the importance of network pharmacology and molecular docking approaches in modern drug discovery research against pancreatic cancer.
Vaishnavi Kurade, Ajit Lad, Nilaji Lad et al.· International Journal of Res...· 0 citations
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