IN-SILICO EVALUATION OF PHYTOCHEMICALS FROM CHRYSOPHYLLUM ALBIDUM FOR DIABETIC WOUND HEALING: TARGETING THE VEGFR-MEDIATED SIGNALING PATHWAY
Abstract
Diabetic wounds remain a major global health concern due to impaired angiogenesis,
oxidative stress, and poor vascular response. This study investigated the wound-healing
potential of Chrysophyllum albidum phytochemicals through in-silico interaction with
vascular endothelial growth factor receptor 2 (VEGFR-2), a key mediator of angiogenesis.
Qualitative and quantitative phytochemical screening revealed the presence of phenols,
alkaloids, saponins, and terpenoids, with phenolic content highest in Sample C (60.1%).
Antioxidant assays demonstrated strong free radical scavenging activity, with DPPH and nitric
oxide inhibition exceeding 90% in some samples. Molecular docking of fifty-nine GC-MS
identified compounds showed that several phytochemicals, notably 7a,9c-(Iminoethano)
phenanthro [4,5-bcd] furan, exhibited higher binding affinity to VEGFR-2 than the standard
drug pioglitazone (−6.8 vs. −6.1 kcal/mol). ADMET predictions confirmed favorable
pharmacokinetic properties, low toxicity, and oral bioavailability, while MM-GBSA analysis
indicated thermodynamically stable ligand-receptor complexes. These findings suggest that C.
albidum possesses potent bioactive compounds capable of modulating VEGFR-2 signaling
and promoting angiogenesis in diabetic wound environments. The study provides a scientific
basis for the ethnomedicinal use of C. albidum and recommends further in-vitro and in-vivo
validation toward developing novel plant-based wound therapies.
Keywords: Chrysophyllum albidum, Diabetic wound, VEGFR-2, Molecular docking,
Antioxidant activity, MM-GBSA
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