Protein tyrosine phosphatase 1B (PTP1B) functions as major negative regulator of insulin and leptin signaling pathways. In view of this, PTP1B is an significant target for drug development against cancer, diabetes and obesity. The aim of the current study is to identify PTP1B inhibitors by means of virtual screening with docking. 523,366 molecules from ZINC database have been screened and based...

Docking is one of the most widely utilized technique used method in structure -based drug design because its capability to predict binding conformation ligands appropriate target. Ability binding/ affinity towards target i.e., bioactive peptides or specific receptor provides strong evidence pattern and for further investigation. Aim- The present study was conducted evaluation current API’s pote...

Abstract Curcumin, a potent phytochemical derived from the spice element turmeric, has been identified as herbal remedy decades ago and displayed promise in field of medicinal chemistry. However, multiple traits associated with curcumin, such poor bioavailability instability, limit its effectiveness to be accepted lead drug-like entity. Different reactive sites chemical structure have incorpora...

The outbreak of coronavirus disease-2019 (COVID-19) had a striking impact on the worldwide healthcare system within very short period. availability large number clinical data SARS-CoV-2, conventional precautionary majors, and treatment strategies with existing therapeutic antiviral drug molecules also fails to control progression disease transmission among population. Hence, we implemented phar...

Objective: The epidermal growth factor has a predominant role in the pathogenesis of non-small cell lung cancer. current is focused on addressing phytocompounds for Ashwagandha as potential therapeutic target Methods: ADME analysis and PyRx were used to screen phytochemicals selected from IMPPAT (Indian Medicinal Plants, Phytochemistry, And Therapeutics). EGFR protein was retrieved PDB (5ZWJ). ...

The present study reports a microwave-assisted method for the synthesis of twelve novel tricyclic 1,4-dihydropyridine derivatives in which dimethyl-substituted cyclohexane and / or tetrahydrothiophene rings are fused to the DHP ring. The structures of the compounds were confirmed by spectral methods and elemental analysis. The potassium channel opening effects of the compounds were determined o...