Hydrazineylidene‐3‐oxopropanal derivatives as antiviral agents for treatment of HBV and HCV: experimental, DFT, and molecular docking studies
In this study, two derivatives of hydrazineylidene‐3‐oxopropanal: chlorophenyl (CPHO) and
Nitrophenyl (NPHO) substituted hydrazineylidene compounds were synthesized …
Nitrophenyl (NPHO) substituted hydrazineylidene compounds were synthesized …
[HTML][HTML] Greener pastures in evaluating antidiabetic drug for a quinoxaline Derivative: Synthesis, Characterization, Molecular Docking, in vitro and HSA/DFT/XRD …
M Missioui, S Mortada, W Guerrab, G Demirtaş… - Arabian Journal of …, 2022 - Elsevier
In an effort to develop a potent antidiabetic drug, new quinoxaline derivative, 2-(4-((3-methyl-
2-oxoquinoxalin-1 (2H)-yl) methyl)-4, 5-dihydro-1H-1, 2, 3-triazol-1-yl)-N-(p-tolyl) acetamide …
2-oxoquinoxalin-1 (2H)-yl) methyl)-4, 5-dihydro-1H-1, 2, 3-triazol-1-yl)-N-(p-tolyl) acetamide …
Computational efforts to identify natural occurring compounds from phyllanthus niruri that target hepatitis B viral infections: DFT, docking and dynamics simulation …
Hepatitis B virus (HBV) is an enveloped hepatotropic virus responsible for nucleic acids
replication. It causes chronic infection. Depending on the strain, mutations in the core protein …
replication. It causes chronic infection. Depending on the strain, mutations in the core protein …
Synthesis, characterization, crystal structure, DFT, HSA, ADMET prediction and antibacterial activity of thiohydantoin analogues
AEMA Allah, W Guerrab, M Maatallah, JT Mague… - Journal of Molecular …, 2024 - Elsevier
In this research, we explore the synthesis and pharmacological evaluation of novel
heterocyclic molecules, drawing inspiration from certain drugs, specifically thiophenytoin. A …
heterocyclic molecules, drawing inspiration from certain drugs, specifically thiophenytoin. A …
3-Allyl-2-(allylthio)-5, 5-diphenyl-3, 5-dihydro-4H-imidazol-4-one: Synthesis, spectroscopic characterization, crystal structure, computational investigations …
In this investigation, we successfully synthesized a novel thiohydantoin derivative, 3-allyl-2-
(allylthio)-5, 5-diphenyl-3, 5-dihydro-4H-imidazol-4-one (AM 1). The compound underwent …
(allylthio)-5, 5-diphenyl-3, 5-dihydro-4H-imidazol-4-one (AM 1). The compound underwent …
Discovery of potential RSK1 inhibitors for cancer therapy using virtual screening, molecular docking, molecular dynamics simulation, and MM/GBSA calculations
S Kalin, F Comert Onder - Journal of Biomolecular Structure and …, 2023 - Taylor & Francis
The p90 ribosomal protein S6 Kinase (RSK) family belongs to Ser/Thr protein kinases that
includes four isoform RSK1-4 in mammals. The ribosomal protein S6 Kinase 1 (RSK1) is …
includes four isoform RSK1-4 in mammals. The ribosomal protein S6 Kinase 1 (RSK1) is …
Investigating the bioactive compounds from Capsicum annum as a probable alternative therapy for prostate cancer treatment: a structure-based drug design …
Prostate cancer remains a significant global health challenge, necessitating the exploration
of novel therapeutic approaches. Androgen receptor (AR) signaling plays a critical role in …
of novel therapeutic approaches. Androgen receptor (AR) signaling plays a critical role in …
[PDF][PDF] Alpha-mangostin, piperine and beta-sitosterol as hepatitis C antivirus (HCV): In silico and in vitro studies
AH Saputro, T Amelia, AB Mahardhika… - Heliyon, 2023 - cell.com
Hepatitis C is still a serious liver case of health. Up to now the development of anti-Hepatitis
C Virus (HCV) drugs is challenging, especially the development of natural material …
C Virus (HCV) drugs is challenging, especially the development of natural material …
[PDF][PDF] FLAVONOID PHYTOPROGESTIN COMPOUNDS AS PROGESTERONE RECEPTOR MODULATORS FOR ENDOMETRIUM RECEPTIVITY: A SYSTEMATIC …
Herbal medicines are gaining popularity as an alternative treatment for women's health
problems, especially infertility. Phytoprogestins are compounds derived from natural …
problems, especially infertility. Phytoprogestins are compounds derived from natural …
[PDF][PDF] Anti-corrosion inhibition of API 5L in hydrochloric acid solution by ethanol extract of Phyllanthus niruri leaf
The inhibitory effects of Phyllanthus niruri leaf extract (PNLE) on API 5L pipeline steel in
hydrochloric acid (HCl) solution were investigated using an electrochemical technique …
hydrochloric acid (HCl) solution were investigated using an electrochemical technique …