Chemical composition, cytotoxicity, and molecular docking analyses of Thuja orientalis extracts
Serkan Kapancık,
Muhammed Safa Çelik,
Mustafa Demiralp
и другие.
Journal of Molecular Structure,
Год журнала:
2024,
Номер
1318, С. 139279 - 139279
Опубликована: Июль 20, 2024
Язык: Английский
The synthesis of novel unnatural amino acid by intramolecular aza‐Michael addition reaction as multitarget enzyme inhibitors
Journal of Biochemical and Molecular Toxicology,
Год журнала:
2024,
Номер
38(9)
Опубликована: Сен. 1, 2024
Abstract
Synthesis
of
novel
unnatural
amino
acids
(UAAs)
from
4‐oxo‐4‐phenylbut‐2‐enoic
acid
derivatives
with
intramolecular
aza‐Michael
addition
reaction
in
the
presence
chlorosulfonyl
isocyanate
(CSI)
was
reported
soft
conditions
without
any
metal
catalyst.
Acids
and
base
as
a
catalyst,
solvents
effects
were
investigated
for
synthesis
UAAs.
This
method
provides
inexpensive,
practicable,
efficient
approach
to
generate
The
use
UAAs
has
attracted
great
interest
development
therapeutic
agents
drug
discovery
improve
their
properties.
In
this
context,
new
UAAs,
inhibition
on
important
metabolic
enzymes
acetylcholinesterase
(AChE)
carbonic
anhydrases
I
II
(hCA
II)
investigated.
compound
2g
showed
best
CA
AChE
enzymes,
while
2i
exhibited
profile
against
isoenzyme.
values
these
compounds
found
1.85
±
0.64
AChE,
0.53
0.07
hCA
I,
0.44
0.15
µM
II,
respectively,
they
stronger
inhibitory
property
than
acetazolamide
(standard
inhibitor
tacrine
AChE)
molecules.
activity
studied
molecule
different
proteins
that
are
(PDB
ID:
2CAB),
5AML),
1OCE)
examined.
Finally,
properties
examined
by
performing
absorption,
distribution,
metabolism,
excretion,
toxicity
analysis.
Язык: Английский
Gypsophila eriocalyx roots inhibit proliferation, migration, and TGF-β signaling in melanoma cells
Turkish Journal of Biochemistry,
Год журнала:
2025,
Номер
unknown
Опубликована: Янв. 7, 2025
Abstract
Objectives
Melanoma
is
a
highly
malignant
and
serious
form
of
skin
cancer.
In
addition
to
the
standard
treatments,
complementary
approaches,
including
phytotherapy,
are
also
used
alleviate
symptoms
improve
patient
well-being.
This
study
aims
investigate
anticancer
effects
Gypsophila
eriocalyx
(GE),
an
endemic
species
from
Türkiye,
on
melanoma
cells.
We
set
out
determine
efficacy
GE
in
inhibiting
cell
proliferation,
migration,
growth,
explore
its
underlying
mechanisms.
Methods
examined
impact
proliferation
two
lines,
Malme-3M
SK-MEL-28,
assessed
developmental
toxicity
zebrafish
embryos.
Next,
we
evaluated
GE’s
influence
colony
formation
wound
healing
cells,
as
well
ability
induce
apoptosis
affect
TGF-β/Smad
signaling
pathway,
by
measuring
pathway
reporter
activity
target
gene
expression.
Results
inhibited
lines
at
concentrations
104
488
times
lower
than
those
required
for
normal
non-malignant
L929
fibroblast
embryos,
demonstrated
only
above
50
μg/mL.
treatment
significantly
impaired
abilities
indicating
reduced
migration.
Moreover,
induced
cells
evidenced
decreased
Conclusions
highlights
potential
novel
therapeutic
agent
demonstrating
inhibit
tumor
growth
progression.
Язык: Английский
Molecular descriptors and in silico studies of 4-((5-(decylthio)-4-methyl-4n-1,2,4-triazol-3-yl)methyl)morpholine as a potential drug for the treatment of fungal pathologies
Computational Biology and Chemistry,
Год журнала:
2024,
Номер
113, С. 108206 - 108206
Опубликована: Сен. 12, 2024
Язык: Английский
Evaluation of Cytotoxicity, Chemical Composition, Antioxidant Potential, Apoptosis Relationship, Molecular Docking, and MM-GBSA Analysis of Rumex crispus Leaf Extracts.
Journal of Molecular Structure,
Год журнала:
2024,
Номер
unknown, С. 140791 - 140791
Опубликована: Ноя. 1, 2024
Язык: Английский
Development of phytotherapeutic nanoformulation containing Gypsophila eriocalyx and its evaluation as a candidate formulation for osteoporosis treatment on human bone marrow stem cells
Phytochemical Analysis,
Год журнала:
2024,
Номер
unknown
Опубликована: Авг. 26, 2024
Abstract
Introduction
Osteoporosis,
one
of
the
common
bone
diseases,
manifests
itself
as
a
decrease
in
mass.
Recently,
use
medicinal
plants
search
for
effective
and
low‐toxicity
therapeutics
prevention
or
treatment
osteoporosis
has
become
trending
topic.
Objective
In
this
study,
we
aim
to
prepare
controlled
drug
carrier
system
loaded
with
Gypsophila
eriocalyx
determine
its
potential
anti‐osteoporosis
applications.
Methods
extract
(GEE)
was
prepared,
components
were
determined.
The
molecular
interactions
Cathepsin
K
(CatK),
which
is
used
target
development
against
osteoporosis,
revealed
by
silico
docking
MD
methods.
ADMET
profiles
also
examined.
GEE‐loaded
chitosan
nanoparticles
(CNPs)
synthesized.
nanoparticles'
morphology,
encapsulation
efficiency,
loading
capacity,
release
profile,
average
size,
polydispersity
index,
zeta
potentials
cytotoxic
effects
GEE
CNPs
on
L929
osteogenic
proliferation
human
marrow
stem
cells
(hBMC)
Results
analysis
no
breaks
atomic
changes
dynamic
system,
confirmed
continued
interaction
identical
residues.
It
determined
that
CNP
formulation
produced
successfully,
had
toxic
effect
L929,
an
hBMC.
Conclusion
line
vitro
results
obtained,
it
evaluated
can
be
candidate
phytotherapeutic
properties
treatment.q1
Язык: Английский
A study on insecticidal activity of the fennel (Foeniculum vulgare) essential oil and its nanoemulsion against stored product pests and molecular docking evaluation
Industrial Crops and Products,
Год журнала:
2024,
Номер
222, С. 119859 - 119859
Опубликована: Окт. 22, 2024
Язык: Английский
Effects of Globularia cordifolia on colon cancer cells: antioxidant activity, inflammatory cytokine analysis and molecular docking studies
Journal of the Science of Food and Agriculture,
Год журнала:
2024,
Номер
unknown
Опубликована: Дек. 27, 2024
Abstract
BACKGROUND
The
present
study
aimed
to
comprehensively
evaluate
the
anticancer,
anti‐inflammatory,
and
antioxidant
properties
of
Globularia
cordifolia
L.
samples.
plant
material
was
collected
extracted
using
maceration
method.
Antioxidant
activities
were
assessed
through
DPPH
(i.e.
2,2‐diphenyl‐1‐picrylhydrazyl)
iron
chelation
assays,
whereas
phenolic
flavonoid
contents
measured
spectrophotometric
methods.
Gas
chromatography‐mass
spectrometry
analysis
performed
identify
biologically
active
compounds.
cytotoxic
effect
on
colon
cancer
cells
evaluated
MTT
[i.e.
2,3‐bis‐(2‐methoxy‐4‐nitro‐5‐sulfophenyl)‐2H‐tetrazolium‐5‐carboxanilide]
inflammatory
cytokine
levels
an
enzyme‐linked
immunosorbent
assay.
Molecular
docking
studies
investigated
interactions
bioactive
compounds
with
4UYA
protein,
ADME
absorption,
distribution,
metabolism,
excretion
toxicity)
modeling
predicted
their
toxicity.
RESULTS
revealed
that
extract
exhibited
strong
activity
a
median
50%
inhibitory
concentration
(IC
50
)
value
39.48
±
2.15
μg
mL
−1
in
assay
effective
capacity
IC
4.28
0.19
mg
.
total
content
662.51
20.95
gallic
acid
equivalents
g
,
114.99
0.51
quercetin
demonstrating
extract's
richness
Significant
antiproliferative
effects
observed
at
dose
250
Inflammatory
indicated
reduction
pro‐inflammatory
responses.
showed
binding
affinities
between
suggesting
mechanisms
action.
CONCLUSION
findings
indicate
G.
exhibits
antioxidant,
anti‐inflammatory
properties,
making
it
promising
biomolecular
agent
for
therapy.
high
contents,
combined
compounds'
key
molecular
targets,
underscore
its
potential
therapeutic
applications.
©
2024
Society
Chemical
Industry.
Язык: Английский