[PDF][PDF] Identification of potential hit compounds for Dengue virus NS2B/NS3 protease inhibitors by combining virtual screening and binding free energy calculations.
Dengue virus (DV) infections are a serious public health problem and there is currently no
vaccine or drug treatment. NS2B/NS3 protease, an essential enzyme for viral replication, is …
vaccine or drug treatment. NS2B/NS3 protease, an essential enzyme for viral replication, is …
Design of new competitive dengue Ns2b/Ns3 protease inhibitors—a computational approach
Dengue is a serious disease which has become a global health burden in the last decade.
Currently, there are no approved vaccines or antiviral therapies to combat the disease. The …
Currently, there are no approved vaccines or antiviral therapies to combat the disease. The …
Anti-viral effectuality of plant polyphenols against mutated dengue protein NS2B47-NS3: a computational exploration
JMJ Rani, K Kalaimathi, S Vijayakumar, G Varatharaju… - Gene Reports, 2022 - Elsevier
Dengue fever is a tropical endemic disease that is transmitted by the female Aedes aegypti
mosquitoes around the world. In dengue patients, the severe vascular leak, bleeding and …
mosquitoes around the world. In dengue patients, the severe vascular leak, bleeding and …
In silico analysis for discovery of dengue virus inhibitor from natural compounds
Dengue fever is a growing global health problem, with millions of virus illnesses occurring
each year. Unfortunately, there is no approved treatment available. DENV NS5 RdRp …
each year. Unfortunately, there is no approved treatment available. DENV NS5 RdRp …
A Step towards Treating Dengue Viral Infection: An In Silico Approach to Identify Potential Antidengue Phytoconstituents
R Pawar, V Patravale - ChemistrySelect, 2020 - Wiley Online Library
Dengue is one of the deadliest mosquito‐borne viral diseases. Since its inception, a lot of
research has happened in various directions, still no effective antiviral drug is available to …
research has happened in various directions, still no effective antiviral drug is available to …
Allosteric pocket of the dengue virus (serotype 2) NS2B/NS3 protease: In silico ligand screening and molecular dynamics studies of inhibition
A Mukhametov, EI Newhouse, N Ab Aziz… - Journal of Molecular …, 2014 - Elsevier
The allosteric pocket of the Dengue virus (DENV2) NS2B/NS3 protease, which is proximal to
its catalytic triad, represents a promising drug target (Othman et al., 2008). We have …
its catalytic triad, represents a promising drug target (Othman et al., 2008). We have …
[HTML][HTML] Molecular docking based screening of plant flavonoids as dengue NS1 inhibitors
MT Ul Qamar, A Mumtaz, R Naseem, A Ali… - …, 2014 - ncbi.nlm.nih.gov
Dengue infection has turned into a serious health concern globally due to its high morbidity
rate and a high possibility of increase in its mortality rate on the account of unavailability of …
rate and a high possibility of increase in its mortality rate on the account of unavailability of …
[PDF][PDF] Molecular docking and drug-likeness study of nirmatrelvir as promising drug candidates of Dengue virus NS2B-NS3 protease.
AKM HUQ, M Roney, SN Tajuddin… - Journal of Research in …, 2023 - researchgate.net
Aedes aegypti is the primary vector for the transmission of the dengue virus (DENV), which
causes dengue fever (DF), dengue hemorrhagic fever (DHF), and dengue shock syndrome …
causes dengue fever (DF), dengue hemorrhagic fever (DHF), and dengue shock syndrome …
Computational approaches for innovative anti-viral drug discovery using Orthosiphon aristatus blume miq against dengue virus
S Zaib, F Akram, W Waris, ST Liaqat… - Journal of …, 2023 - Taylor & Francis
Dengue virus has emerged as infectious mosquito borne disease involved in lowering
platelets and white blood cells (WBC) count particularly. The genome structure is based on …
platelets and white blood cells (WBC) count particularly. The genome structure is based on …
Discovery of novel small molecule inhibitors of dengue viral NS2B-NS3 protease using virtual screening and scaffold hopping
J Deng, N Li, H Liu, Z Zuo, OW Liew, W Xu… - Journal of medicinal …, 2012 - ACS Publications
By virtual screening, compound 1 was found to be active against NS2B-NS3 protease
(IC50= 13.12±1.03 μM). Fourteen derivatives (22) of compound 1 were synthesized, leading …
(IC50= 13.12±1.03 μM). Fourteen derivatives (22) of compound 1 were synthesized, leading …