Overcoming challenges in structural biology with integrative approaches and nanobody-derived technologies

M Condeminas, MJ Macias - Current Opinion in Structural Biology, 2024 - Elsevier
A full understanding of protein structure is key to unraveling how these systems work, how
mutations affect their function, and discovering new hotspots for drug discovery. Research …

Mitogen-activated protein kinase-guided drug discovery for post-viral and related types of lung disease

MJ Holtzman, Y Zhang, K Wu… - European Respiratory …, 2024 - Eur Respiratory Soc
Respiratory viral infections are a major public health problem, with much of their morbidity
and mortality due to post-viral lung diseases that progress and persist after the active …

A comprehensive exploration of the druggable conformational space of protein kinases using AI-predicted structures

NB Herrington, YC Li, D Stein, G Pandey… - PLOS Computational …, 2024 - journals.plos.org
Protein kinase function and interactions with drugs are controlled in part by the movement of
the DFG and ɑC-Helix motifs that are related to the catalytic activity of the kinase. Small …

Dual-action kinase inhibitors influence p38α MAP kinase dephosphorylation

EJ Stadnicki, H Ludewig, RP Kumar, X Wang… - Proceedings of the …, 2025 - pnas.org
Reversible protein phosphorylation directs essential cellular processes including cell
division, cell growth, cell death, inflammation, and differentiation. Because protein …

[HTML][HTML] Structures, dynamics, complexes, and functions: From classic computation to artificial intelligence

E Frasnetti, A Magni, M Castelli, SA Serapian… - Current Opinion in …, 2024 - Elsevier
Computational approaches can provide highly detailed insight into the molecular
recognition processes that underlie drug binding, the assembly of protein complexes, and …

Combinatorial Targeting of Common Docking and ATP Binding Sites on Mps1 MAPK for Management of Pathogenic Fungi

Z Kong, S Li, J Li, Y Chen, M Chen… - Journal of Agricultural …, 2024 - ACS Publications
Resistance in pathogenic fungi necessitates the development of fungicides with new
mechanisms of action. The Mps1 MAPK of Magnaporthe oryzae, the pathogen of rice blast …

[HTML][HTML] MAPK Signaling Cascades in Human Health and Diseases

R Seger - International Journal of Molecular Sciences, 2024 - mdpi.com
In order to survive and fulfil their functions, cells of any organism need to be able to respond
to a large number of extracellular factors, also termed extracellular stimuli. These responses …

CD146-dependent macrophage infiltration promotes epidural fibrosis via the Erdr1/ERK/CCR2 pathway

J Sun, M Shi, Z Song, F Hua, X Yan, M Zhang… - International …, 2024 - Elsevier
Low back pain due to epidural fibrosis is a major complication after spine surgery.
Macrophages infiltrate the wound area post laminectomy, but the role of macrophages in …

[HTML][HTML] Discovery of pyrazolo [3, 4-d] pyrimidines as novel mitogen-activated protein kinase kinase 3 (MKK3) inhibitors

JE Takarada, MR Cunha, VM Almeida… - Bioorganic & Medicinal …, 2024 - Elsevier
The dual-specificity protein kinase MKK3 has been implicated in tumor cell proliferation and
survival, yet its precise role in cancer remains inconclusive. A critical step in elucidating the …

A first-in-kind MAPK13 inhibitor that can correct stem cell reprogramming and post-injury disease

Y Zhang, K Wu, D Mao, CA Iberg, H Yin-Declue… - …, 2024 - pmc.ncbi.nlm.nih.gov
The stress kinase MAPK13 (aka p38δ-MAPK) is an attractive entry point for therapeutic
intervention because it regulates the structural remodeling that can develop after epithelial …