Anti-obesity mechanisms elucidation of essential oil components from Artemisiae Argyi Folium (Aiye) by the integration of GC-MS, network pharmacology, and molecular docking
International Journal of Food Properties,
Год журнала:
2025,
Номер
28(1)
Опубликована: Янв. 21, 2025
Язык: Английский
Elucidation of Anti-Obesity Mechanisms of Phenolics in Artemisiae argyi Folium (Aiye) by Integrating LC-MS, Network Pharmacology, and Molecular Docking
Life,
Год журнала:
2024,
Номер
14(6), С. 656 - 656
Опубликована: Май 22, 2024
The
global
prevalence
of
obesity
is
a
pressing
health
issue,
increasing
the
medical
burden
and
posing
significant
risks
to
humans.
side
effects
complications
associated
with
conventional
medication
surgery
have
spurred
search
for
anti-obesity
drugs
from
plant
resources.
Previous
studies
suggested
that
Artemisiae
argyi
Folium
(Aiye)
water
extracts
could
inhibit
pancreatic
lipase
activities,
control
body
weight
increase,
improve
plasma
lipids
profile.
However,
exact
components
mechanisms
were
not
precisely
understood.
Therefore,
this
research
aims
identify
chemical
profile
Aiye
provide
comprehensive
prediction
its
mechanisms.
extract
was
subjected
LC-MS
analysis,
which
identified
30
phenolics.
these
phenolics
then
predicted,
employing
network
pharmacology
molecular
docking.
Among
phenolics,
21
passed
drug-likeness
screening
exhibited
486
targets.
enrichment
analysis
revealed
may
combat
through
PI3K-Akt
signaling
MAPK,
prolactin,
cAMP
pathways.
Eight
seven
central
targets
selected
docking,
45
out
56
docking
had
binding
affinity
less
than
−5
kcal/mol.
This
has
indicated
potential
therapy
pathways
in
combating
obesity.
Язык: Английский
The Mechanism of Mori Folium and Eucommiae Cortex against Cyclophosphamide-Induced Immunosuppression Integrating Network Pharmacology, Molecular Docking, Molecular Dynamics Simulations, and Experimental Validation
Metabolites,
Год журнала:
2023,
Номер
13(11), С. 1151 - 1151
Опубликована: Ноя. 15, 2023
It
has
been
reported
that
Mori
Folium
(MF)
and
Eucommiae
Cortex
(EC)
exhibit
pharmacological
effects
in
the
treatment
of
immunosuppression.
However,
mechanism
MF
EC
against
immunosuppression
remains
unclear.
This
study
aims
to
explore
action
for
through
network
pharmacology,
molecular
docking,
dynamics
simulations
animal
experiments.
As
a
result,
11
critical
components,
9
hub
targets,
related
signaling
pathways
were
obtained
based
on
pharmacology.
The
docking
suggested
components
exhibited
great
binding
affinity
targets
results
showed
(-)-tabernemontanine-AR,
beta-sitosterol-AR
Dehydrodieugenol-HSP90AA1
complexes
are
stably
bound.
Additionally,
experiments,
treated
group
compared
control
suggest
have
significant
effect
Therefore,
may
take
multi-component,
multi-target,
multi-pathway
manner.
herein
provide
novel
insights
into
humans.
Язык: Английский
The Pharmacological Mechanisms of Mori Folium and Eucommiae Cortex Extracts against Immunosuppression from Network Pharmacology Perspectives
Опубликована: Окт. 17, 2023
It’s
been
reported
that
Mori
Folium
(MF)
and
Eucommiae
Cortex
(EC)
exhibit
pharmacological
effects
on
the
treatment
of
immunosuppression.
However,
mechanism
MF
EC
against
immunosuppression
remains
unclear.
This
study
aims
to
explore
action
for
through
network
pharmacology,
molecular
docking,
dynamics
simulations
animal
experiments.
As
a
result,
11
critical
components,
9
hub
targets,
related-signaling
pathways
were
obtained
based
pharmacology.
The
docking
suggested
components
exhibited
great
binding
affinity
targets
results
showed
(-)-Tabernemontanine-AR,
beta-sitosterol-AR
Dehydrodieugenol-HSP90AA1
complexes
are
stably
bound.
Additionally,
in
experiments,
treated
group
compared
control
suggest
have
significant
effect
Therefore,
may
take
multi-component,
multi-target,
multi-pathway
manner.
would
provide
novel
insights
into
humans.
Язык: Английский
Exploring the Molecular Mechanism of Niuxi-Mugua Formula in Treating Coronavirus Disease 2019 via Network Pharmacology, Computational Biology, and Surface Plasmon Resonance Verification
Current Computer - Aided Drug Design,
Год журнала:
2023,
Номер
20(7), С. 1113 - 1129
Опубликована: Окт. 19, 2023
In
China,
Niuxi-Mugua
formula
(NMF)
has
been
widely
used
to
prevent
and
treat
coronavirus
disease
2019
(COVID-19).
However,
the
mechanism
of
NMF
for
treating
COVID-19
is
not
yet
fully
understood.
Язык: Английский