Natural products and conventional chemotherapeutic drugs
are believed
to enhance anticancer treatment efficacy while lowering toxicity.
The current study investigates the cytotoxic and apoptogenic effects
of Monotheca buxifolia bioactive compounds
on HepG2 cell lines. MTT assay was used to assess the effect on the
viability of HepG2 cells. Morphological changes were investigated.
Annexin-V-FITC/PI was used to demonstrate apoptotic activity. A molecular
dynamics simulation study was carried out to investigate the compound
binding pattern in the active site of the PPRAδ protein. MTT
and annexin V-FITC/PI assays revealed that the isolated compounds
lauric acid, oleanolic acid, and bis(2-ethylhexyl) phthalate inhibited
the growth of hepatocellular cancer cells. The IC50 value
for lauric acid was 56.46 ± 1.20 μg/mL, 31.94 ± 1.03
μg/mL for oleanolic acid, and 83.80 ± 2.18 μg/mL
for bis(2-ethylhexyl) phthalate. Apoptosis was observed in 29.5, 52.1
and 22.4% of HepG2 cells treated with lauric acid, oleanolic acid,
and bis(2-ethylhexyl) phthalate, respectively, after 24 h of treatment.
Morphological assays and Hoechst staining microscopy revealed that
the treatment caused morphological changes in the cell membrane and
nuclear condensation. The high fluctuation indicates that various
interactions were highly potent and widely adopted, and vice versa.
Oleanolic acid displayed high residue fluctuation, remaining stable
in the active site of the PPRAδ protein and involved in various
interactions while remaining locally fluctuating in the binding sites
of the other two compounds. These findings concluded that lauric acid,
oleanolic acid, and bis(2-ethylhexyl) phthalate have a significant
apoptogenic effect against HepG2 cells in inducing apoptosis. Our
findings suggest that these bioactive compounds could be used as adjuvant
therapies.