Adenocarpine, Marmesin, and Lycocernuine from Ficus benjamina as Promising Inhibitors of Aldose Reductase in Diabetes: A Bioinformatics-Guided Approach
Applied Biochemistry and Biotechnology,
Journal Year:
2025,
Volume and Issue:
unknown
Published: Jan. 21, 2025
Language: Английский
Computational Insights into the Inhibition of Cell Division in Staphylococcus aureus: Towards Novel Therapeutics
Rajendra Bhati,
No information about this author
Alimuddin Saifi,
No information about this author
M. S. Sangwan
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et al.
Computational Biology and Chemistry,
Journal Year:
2025,
Volume and Issue:
117, P. 108391 - 108391
Published: Feb. 26, 2025
Language: Английский
Identification of Potential Anticancer Phytochemicals of Piper chaba by Comprehensive Molecular Docking, Molecular Dynamics Simulation and In‐Vitro Studies
Chemistry & Biodiversity,
Journal Year:
2025,
Volume and Issue:
unknown
Published: March 18, 2025
ABSTRACT
Human
colon
cancer
and
prostate
are
the
most
common
malignancy
globally.
Despite
availability
of
many
treatments,
resistance
to
traditional
medicines,
such
as
chemotherapy
radiotherapy,
remains
a
severe
obstacle
in
treatment.
Hence,
searching
for
new
therapeutic
options
is
utmost
priority.
The
present
investigation
evaluates
in‐silico
in‐vitro
anticancer
potential
phytochemicals
Piper
chaba
.
cytotoxicity
results
demonstrated
that
plant
extract
exhibited
significant
activity,
with
IC
50
values
12.66
±
0.25
µg/mL
HCT‐116
19.49
0.37
DU‐145.
Molecular
docking
molecular
dynamics
simulations
were
performed
explore
interaction
drug
targets
phytochemicals.
Subsequently,
pharmacokinetic
parameters
calculations
evaluate
drug‐likeness.
Piperine
exhibits
highest
binding
affinity
vascular
endothelial
growth
factor
receptor‐2
(VEGFR2)
protein
score
−9.71
kcal/mol.
Sylvatine
had
greater
human
epidermal
receptor
3
(HER3)
than
other
Isopiperine,
chabamide,
Piperlonguminine,
Santamarine
Versalide
only
ligand
activity
IKK
beta
(inhibitor
kappa
B
kinase).
Additionally,
principal
component
analysis
was
strengthen
investigation's
scope.
These
proposed
reported
possess
VEGFR2,
HER2
inhibition.
best
phytochemical
hits
have
excellent
hold
massive
potential,
opening
up
avenues
prospective
future
investigations
Language: Английский
Carvacrol Effectively Inhibits Pseudomonas tolaasii In Vitro and Induces Resistance to Brown Blotch Disease in Postharvest Agaricus bisporus
Lei Zhang,
No information about this author
Rui Song,
No information about this author
Zixuan Shi
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et al.
Foods,
Journal Year:
2024,
Volume and Issue:
13(22), P. 3689 - 3689
Published: Nov. 19, 2024
Carvacrol
(CAR),
a
naturally
occurring
phenolic
monoterpene
compound,
has
recently
received
attention
for
its
potential
use
in
food
preservation.
However,
whether
it
is
effective
controlling
brown
blotch
disease
caused
by
Language: Английский