Theoretical Investigation, Synthesis, Characterization, Molecular docking, predicted PkCSM and Profound Biological Implication of vanadium metal complexes DOI

Mohd Washid Khan,

Dayanshi Kuroliya,

Shruti Shivhare

et al.

International Journal of Newgen Research in Pharmacy & Healthcare, Journal Year: 2024, Volume and Issue: unknown, P. 95 - 104

Published: June 30, 2024

Sulfanilic acid (SNA) and trimethoprim (TMP) cure bacterial urinary tract infections. Molecular features like binding sites, electronic states, chemical reactivity, optical properties, FTIR spectra have been estimated computationally. Sulfonamides metal-sulfonamide complexes many medicinal applications. Chemistry researchers students use ChemOffice to create papers databases. The modules include ChemDraw Ultra, Chem3D E-Notebook ChemFinder, CombiChem, Inventory, Bioassay. edits chemicals two-dimensionally. Pharmacokinetics, toxicity, potency must interact for successful medications. Compound absorption, distribution, metabolism, excretion (ADME) are defined by its pharmacokinetic profile. docking predicts the preferred orientation of molecules in stable complexes, enabling structure-based medication development. Drug development balance pharmacokinetics, efficacy, safety optimizing drug-like properties. efficacy depends on potency. In general, Overtone's notion Tweedy's chelation hypothesis explain vanadium ligand complexes' improved actions. Chelation reduces polarity metal ion due partial sharing positive charge with donor groups p-electron delocalization whole chelating ring. Increased lipophilicity helps penetrate lipid membranes block all microorganism enzyme sites. These disrupt respiration impede protein synthesis, limiting organism growth. While optimal qualities a new medicine therapeutic target important, reaching site adequate concentrations deliver physiological effect safely is critical clinic introduction.

Language: Английский

Synergistic effects of β-Cyclodextrin derivative inclusion complexes with favipiravir to enhance solubility and antiviral efficacy against Herpes Simplex virus type 1 (HSV-1) DOI
Sonaimuthu Mohandoss,

Kuppu Sakthi Velu,

Rizwan Wahab

et al.

Journal of Molecular Liquids, Journal Year: 2024, Volume and Issue: unknown, P. 126064 - 126064

Published: Sept. 1, 2024

Language: Английский

Citations

2
Intelligent machine learning enabled sensor for acyclovir using NiMnO3 flower-like electrocatalyst DOI

Nabi Bux,

Sadam Hussain,

Tarık Küçükdeniz

et al.

Materials Science and Engineering B, Journal Year: 2024, Volume and Issue: 309, P. 117668 - 117668

Published: Aug. 31, 2024

Language: Английский

Citations

1
Harnessing PROTACs to combat H5N1 influenza: A new frontier in viral destruction DOI Creative Commons
Nobendu Mukerjee, Swastika Maitra, Dattatreya Mukherjee

et al.

Journal of Medical Virology, Journal Year: 2024, Volume and Issue: 96(9)

Published: Sept. 1, 2024

Abstract H5N1, a highly pathogenic avian influenza virus, poses an ongoing and significant threat to global public health, primarily due its potential cause severe respiratory illness high mortality rates in humans. Despite extensive efforts vaccination antiviral therapy, H5N1 continues exhibit mutation rates, resulting recurrent outbreaks the emergence of drug‐resistant strains. Traditional therapies, such as neuraminidase inhibitors M2 ion channel blockers, have demonstrated limited efficacy, necessitating exploration innovative therapeutic strategies. Proteolysis‐targeting chimeras (PROTACs) emerge novel promising approach, leveraging ubiquitin‐proteasome system selectively degrade proteins. Unlike conventional that only block protein function, PROTACs eliminate target protein, providing sustained effect potentially reducing development resistance. This paper offers comprehensive examination current landscape infections, detailing pathogenesis challenges associated with existing treatments. It further explores mechanism action, design, inhibiting H5N1. By targeting essential viral proteins, hemagglutinin RNA‐dependent RNA polymerase complex, hold revolutionize treatment offering new frontier therapy.

Language: Английский

Citations

1
Theoretical Investigation, Synthesis, Characterization, Molecular docking, predicted PkCSM and Profound Biological Implication of vanadium metal complexes DOI

Mohd Washid Khan,

Dayanshi Kuroliya,

Shruti Shivhare

et al.

International Journal of Newgen Research in Pharmacy & Healthcare, Journal Year: 2024, Volume and Issue: unknown, P. 95 - 104

Published: June 30, 2024

Sulfanilic acid (SNA) and trimethoprim (TMP) cure bacterial urinary tract infections. Molecular features like binding sites, electronic states, chemical reactivity, optical properties, FTIR spectra have been estimated computationally. Sulfonamides metal-sulfonamide complexes many medicinal applications. Chemistry researchers students use ChemOffice to create papers databases. The modules include ChemDraw Ultra, Chem3D E-Notebook ChemFinder, CombiChem, Inventory, Bioassay. edits chemicals two-dimensionally. Pharmacokinetics, toxicity, potency must interact for successful medications. Compound absorption, distribution, metabolism, excretion (ADME) are defined by its pharmacokinetic profile. docking predicts the preferred orientation of molecules in stable complexes, enabling structure-based medication development. Drug development balance pharmacokinetics, efficacy, safety optimizing drug-like properties. efficacy depends on potency. In general, Overtone's notion Tweedy's chelation hypothesis explain vanadium ligand complexes' improved actions. Chelation reduces polarity metal ion due partial sharing positive charge with donor groups p-electron delocalization whole chelating ring. Increased lipophilicity helps penetrate lipid membranes block all microorganism enzyme sites. These disrupt respiration impede protein synthesis, limiting organism growth. While optimal qualities a new medicine therapeutic target important, reaching site adequate concentrations deliver physiological effect safely is critical clinic introduction.

Language: Английский

Citations

0