Design of metronidazole derivatives and flavonoids as potential non-nucleoside reverse transcriptase inhibitors using combined ligand-and structure-based …

PF Cutinho, J Roy, A Anand, R Cheluvaraj… - Journal of …, 2019 - Taylor & Francis
Abstract Acquired Immuno Defficiency Syndrome (AIDS) is one of the major global life
threatening condition caused by Human Immunodeficiency Virus (HIV) and its prevalence …

Novel partially reversible NDM-1 inhibitors based on the naturally occurring houttuynin

L Wang, Y Liang, P Luo, M Huang, Y Wan - Bioorganic Chemistry, 2024 - Elsevier
Discovering novel NDM-1 inhibitors is an urgent task for treatment of 'superbug'infectious
diseases. In this study, we found that naturally occurring houttuynin and its sulfonate …

Computational and data mining studies to understand the distribution and dynamics of Temoneria (TEM) β-lactamase and their interaction with β-lactam and β …

P Gehlot, P Hariprasad - Environmental Pollution, 2022 - Elsevier
Abstract β-lactams are large group of antibiotics widely used to suppress the bacterial
growth by inhibiting cell wall synthesis. Bacterial resistance against β-lactam antibiotics is …

Design, Synthesis and Antibacterial Activity Evaluation of Ebselen Derivatives as NDM-1 Inhibitors

W Meng, C Liu, G Wu, Z Bai, Z Wang, W Liu… - Available at SSRN … - papers.ssrn.com
Abstract New Delhi-β-lactamase-1 (NDM-1) is a type of one of metal-β-lactamase. NDM-1-
expressing bacteria can rapidly spread globally through plasmid transfer, greatly …

In silico analysis of marine natural product for protein arginine methyltransferase 5 (PRMT5) inhibitors based on pharmacophore and molecular docking

L Luo, H Tan, Y Liao - Journal of Biomolecular Structure and …, 2023 - Taylor & Francis
Over the past few decades, various inhibitors of PRMT5 have been developed because of its
involvement in a variety of tumor development processes. As of now, no drugs targeting …

Prediction of matrix metal proteinases-12 inhibitors by machine learning approaches

B Li, L Hu, Y Xue, M Yang, L Huang… - Journal of …, 2019 - Taylor & Francis
Abstract Matrix metal proteinases-12 (MMP-12) is a hot pharmaceutical target on the
treatment of many human diseases. There'sa crying need for designing and finding new …

Computational design of MmpL3 inhibitors for tuberculosis therapy

R Chaitra, R Gandhi, N Jayanna, S Satyanath… - Molecular Diversity, 2023 - Springer
Tuberculosis is a chronic communicable disease caused by Mycobacterium tuberculosis
(Mtb) and spreads from lungs to lymphatic system. The cell wall of mycobacterium plays a …

Fragment-based discovery of new potential DNMT1 inhibitors integrating multiple pharmacophore modeling, 3D-QSAR, virtual screening, molecular docking, ADME …

G Lanka, S Banerjee, N Adhikari, B Ghosh - Molecular Diversity, 2024 - Springer
DNA methyl transferases (DNMTs) are one of the crucial epigenetic modulators associated
with a wide variety of cancer conditions. Among the DNMT isoforms, DNMT1 is correlated …

Aurones and derivatives as promising New Delhi metallo-β-lactamase (NDM-1) inhibitors

J Caburet, F Verdirosa, M Moretti, B Roulier… - Bioorganic & Medicinal …, 2024 - Elsevier
Bacterial resistance is undoubtedly one of the main public health concerns especially with
the emergence of metallo-β-lactamases (MBLs) able to hydrolytically inactivate β-lactam …

[引用][C] Proteome Wide Exploration of Drug Candidates Against Multidrug-Resistant Citrobacter freundii.

L Ghaz - 2023 - Quaid I Azam university Islamabad