[PDF][PDF] Anti-melanogenic, antioxidant potentialities and metabolome classification of six Ocimum species: Metabolomics and in-silico approaches

S Sarkar, M Hoda, S Das - Trends in Phytochemical Research, 2023 - journals.iau.ir
The whole process of melanin synthesis is known as melanogenesis. Tyrosinase (EC1.
14.18. 1) is the main phenolic oxidase enzyme under the metallo-protein group. This group …

Galangal–Cinnamon Spice Mixture Blocks the Coronavirus Infection Pathway through Inhibition of SARS-CoV-2 MPro, Three HCoV-229E Targets; Quantum …

DG El-Hosari, WM Hussein, MO Elgendy, SO Elgendy… - Pharmaceuticals, 2023 - mdpi.com
Natural products such as domestic herbal drugs which are easily accessible and cost-
effective can be used as a complementary treatment in mild and moderate COVID-19 cases …

Comparative assessment of 9-bromo noscapine ionic liquid and noscapine: Synthesis, in-vitro studies plus computational & biophysical evaluation with human …

S Sewariya, H Sehrawat, N Mishra, MB Singh… - International Journal of …, 2023 - Elsevier
Noscapine is a proficient anticancer drug active against wide variety of tumors including
lung cancer. Over time, several noscapine analogues have been assessed to maximize the …

Influence of solvation on the spectral, molecular structure, and antileukemic activity of 1-benzyl-3-hydroxy-2-methylpyridin-4 (1H)-one

P Nkoe, ALE Manicum, H Louis, FP Malan… - Journal of Molecular …, 2023 - Elsevier
This research focuses on the synthesis, X-ray crystallography, spectral characterization, and
the influence of solvents on electronic molecular properties, vibrational analysis, and …

Anti-obesity, antioxidant and in silico evaluation of Justicia carnea bioactive compounds as potential inhibitors of an enzyme linked with obesity: Insights from kinetics …

AA Anigboro, OJ Avwioroko, O Akeghware… - Biophysical …, 2021 - Elsevier
Obesity is a global health problem characterized by excessive fat deposition in adipose
tissues and can be managed by targeting pancreatic lipase (PL) activity. In the present …

QSAR studies, molecular docking, molecular dynamics, synthesis, and biological evaluation of novel quinolinone-based thiosemicarbazones against Mycobacterium …

J Valencia, V Rubio, G Puerto, L Vasquez, A Bernal… - Antibiotics, 2022 - mdpi.com
In this study, a series of novel quinolinone-based thiosemicarbazones were designed in
silico and their activities tested in vitro against Mycobacterium tuberculosis (M. tuberculosis) …

Pyrimidine-based sulfonamides and acetamides as potent antimicrobial Agents: Synthesis, Computational Studies, and biological assessment

S Indalkar, DK Sahoo, DS Bhange, M Waghmode… - Bioorganic …, 2024 - Elsevier
A series of novel sulfonamide and acetamide derivatives of pyrimidine were synthesized
and their antimicrobial activities were assessed. Based on the Microbroth dilution method …

[HTML][HTML] Dataset on the DFT-QSAR, and docking approaches for anticancer activities of 1, 2, 3-triazole-pyrimidine derivatives against human esophageal carcinoma …

RO Adegoke, AK Oyebamiji, B Semire - Data in brief, 2020 - Elsevier
The investigation of the novel hybrid, 1, 2, 3-triazole moiety combined with pyrimidine
derivatives against human esophageal carcinoma is an unexplored field of theoretical …

Synthesis, experimental and theoretical spectra, electronic and medicinal properties of 3-(3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl)-5-ethoxy-4H-1, 2, 4-triazole

MBA Titlin, TR Beena, M Nikpassand, F Akman… - Journal of Molecular …, 2025 - Elsevier
Abstract In this work, 3-(3-(4-Chlorophenyl)-1-phenyl-1H-pyrazol-4-yl)-5-ethoxy-4H-1, 2, 4-
triazole compound has been synthesized and experimentally (FT-IR and 1H and 13Csingle …

1, 2, 3-triazole and chiral Schiff base hybrids as potential anticancer agents: DFT, molecular docking and ADME studies

Y Belay, A Muller, FS Mokoena, AS Adeyinka… - Scientific Reports, 2024 - nature.com
Abstract A series of novel 1, 2, 3-triazole and chiral Schiff base hybrids 2–6 were
synthesized by Schiff base condensation reaction from pre-prepared parent component of …