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Author

Jagadish Singh

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Open access Sep 2026

Design, synthesis, SAR, in silico and in vitro evaluation of 1, 3, 4-oxadiazole derivatives against breast cancer

R3 emerges as a promising VEGFR2-targeted lead for further breast cancer drug development and structure-activity relationship analysis indicated that meta and para chloro substitutions enhance binding and activity, while ortho substitution reduces affinity due to steric effects.

Rekha Singh, B. Matore, A. Murmu et al. · 0 citations
Review Open access Sep 2026

Toxicity assessment of agrochemical and pharmaceutical metabolites using artificial intelligence machine learning and computational approaches

The review revisits metabolite toxicity using machine learning (ML), artificial intelligence (AI) and computational tools for metabolite formation and toxicity prediction and highlighted the various metabolome databases useful for the data collection and metabolite analysis.

Souranava Jana, B. Matore, A. Murmu et al. · 0 citations

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