An update regarding the role of WNK kinases in cancer
M Xiu, L Li, Y Li, Y Gao - Cell Death & Disease, 2022 - nature.com
Mammalian WNK kinases (WNKs) are serine/threonine kinases that contain four members,
WNK1–4. They function to maintain ion homeostasis and regulate blood pressure in …
WNK1–4. They function to maintain ion homeostasis and regulate blood pressure in …
Identification of potential inhibitors against Epstein–Barr virus nuclear antigen 1 (EBNA1): An insight from docking and molecular dynamic simulations
Epstein–Barr virus (EBV), a known tumorigenic virus, is associated with various
neuropathies, including multiple sclerosis (MS). However, there is no anti-EBV FDA …
neuropathies, including multiple sclerosis (MS). However, there is no anti-EBV FDA …
Computational investigation of structural dynamics of SARS-CoV-2 methyltransferase-stimulatory factor heterodimer nsp16/nsp10 bound to the cofactor SAM
Recently, a highly contagious novel coronavirus disease 2019 (COVID-19), caused by
SARS-CoV-2, has emerged, posing a global threat to public health. Identifying a potential …
SARS-CoV-2, has emerged, posing a global threat to public health. Identifying a potential …
XGBoost odor prediction model: finding the structure-odor relationship of odorant molecules using the extreme gradient boosting algorithm
Determining the structure-odor relationship has always been a very challenging task. The
main challenge in investigating the correlation between the molecular structure and its …
main challenge in investigating the correlation between the molecular structure and its …
Unraveling the molecular mechanism of recognition of selected next-generation antirheumatoid arthritis inhibitors by Janus kinase 1
Rheumatoid arthritis (RA) is a chronic immune-related condition, primarily of joints, and is
highly disabling and painful. The inhibition of Janus kinase (JAK)-related cytokine signaling …
highly disabling and painful. The inhibition of Janus kinase (JAK)-related cytokine signaling …
Finding potent inhibitors against SARS-CoV-2 main protease through virtual screening, ADMET, and molecular dynamics simulation studies
Currently, no antiviral drug or vaccine is available to treat COVID-19 caused by SARS-CoV-
2. This underscores an urgent need for developing a drug against SARS-CoV-2. The main …
2. This underscores an urgent need for developing a drug against SARS-CoV-2. The main …
Identification of Food Compounds as inhibitors of SARS-CoV-2 main protease using molecular docking and molecular dynamics simulations
SARS-CoV-2 has rapidly emerged as a global pandemic with high infection rate. At present,
there is no drug available for this deadly disease. Recently, M pro (Main Protease) enzyme …
there is no drug available for this deadly disease. Recently, M pro (Main Protease) enzyme …
Molecular level investigation for identifying potential inhibitors against thymidylate kinase of monkeypox through in silico approaches
The need for more advanced and effective monkeypox (Mpox) treatments has become
evident with numerous Mpox virus (MPXV) outbreaks. Over the years, interest has increased …
evident with numerous Mpox virus (MPXV) outbreaks. Over the years, interest has increased …
Mining of Ebola virus genome for the construction of multi-epitope vaccine to combat its infection
Ebola virus is the primary causative agent of viral hemorrhagic fever that is an epidemic
disease and responsible for the massive premature deaths in humans. Despite knowing the …
disease and responsible for the massive premature deaths in humans. Despite knowing the …
Elucidating specificity of an allosteric inhibitor WNK476 among With‐No‐Lysine kinase isoforms using molecular dynamic simulations
N Amarnath Jonniya, MF Sk… - Chemical Biology & Drug …, 2021 - Wiley Online Library
Abstract Specifically targeting the With‐No‐Lysine (WNK1) kinase, which is implicated in
hypertension, renders a significant challenge in discovering competitive inhibitors due to the …
hypertension, renders a significant challenge in discovering competitive inhibitors due to the …