Targeting HSP90 for cancer therapy: current progress and emerging prospects

X Liang, R Chen, C Wang, Y Wang… - Journal of Medicinal …, 2024 - ACS Publications
Heat shock protein 90 (HSP90), a highly conserved member of the heat shock protein family,
regulates various proteins and signaling pathways involved in cancer, making it a promising …

Anticancer Drug Discovery based on Natural products: from computational approaches to Clinical studies

P Chunarkar-Patil, M Kaleem, R Mishra, S Ray… - Biomedicines, 2024 - mdpi.com
Globally, malignancies cause one out of six mortalities, which is a serious health problem.
Cancer therapy has always been challenging, apart from major advances in …

Molecular docking, molecular dynamics, MM/PBSA approaches and bioactivity studies of nepetanudoside B isolated from endemic Nepeta aristata

Y Başar, İ Demirtaş, S Yenigün, Y İpek… - Journal of …, 2024 - Taylor & Francis
Nepetanudoside B (NNB) was isolated from aerial parts of endemic Nepeta aristata crude
extract (CH3OH-CHCl3) using silica gel (n-hexane, methanol, ethyl acetate, and …

CORAL: probing the structural requirements for α-amylase inhibition activity of 5-(3-arylallylidene)-2-(arylimino) thiazolidin-4-one derivatives based on QSAR with …

R Singh, P Kumar, J Sindhu, A Kumar… - Journal of Biomolecular …, 2024 - Taylor & Francis
The present study aims to examine the structural requirements governing α-amylase
inhibitory activity of 5-(3-arylallylidene)-2-(arylimino) thiazolidin-4-one derivatives and their …

[HTML][HTML] Exploring the therapeutic targets of stevioside in management of type 2 diabetes by network pharmacology and in-silico approach

A Dutta, MA Hossain, PD Somadder, MA Moli… - Diabetes & Metabolic …, 2024 - Elsevier
Aims The main objective of the current study is to investigate the pathways and therapeutic
targets linked to stevioside in the management of T2D using computational approaches …

[HTML][HTML] Recent advances in therapies for primary myelofibrosis

W Vainchenker, N Yahmi, V Havelange, C Marty… - Faculty …, 2023 - ncbi.nlm.nih.gov
Primary myelofibrosis (PMF), polycythemia vera (PV) and essential thrombocythemia (ET)
form the classical BCR-ABL1-negative myeloproliferative neoplasms (MPNs) that are driven …

Unlocking the potential of approved drugs for the allosteric inhibition of tropomyosin-receptor kinase A using molecular docking and molecular dynamics studies

RM Mukhtar, N Abdelmoniem, HA Elrufaie… - Frontiers in …, 2023 - frontiersin.org
Tropomyosin-receptor kinase A (TrkA) is the primary isoform among the tropomyosin-
receptor kinases that have been associated with human cancer development, contributing to …

Design of new Mcl-1 inhibitors for cancer using fragments hybridization, molecular docking, and molecular dynamics studies

AA Alzain, FA Elbadwi, RM Mukhtar… - Journal of …, 2025 - Taylor & Francis
Apoptosis is a critical process that regulates cell survival and death and plays an essential
role in cancer development. The Bcl-2 protein family, including myeloid leukemia 1 (Mcl-1) …

Small molecule inhibitors targeting heat shock protein 90: An updated review

Y Li, J Dong, JJ Qin - European Journal of Medicinal Chemistry, 2024 - Elsevier
As a molecular chaperone, heat shock protein 90 (HSP90) plays important roles in the
folding, stabilization, activation, and degradation of over 500 client proteins, and is …

A Review on Molecular Docking on HDAC Isoforms: Novel Tool for Designing Selective Inhibitors

A Drakontaeidi, E Pontiki - Pharmaceuticals, 2023 - mdpi.com
Research into histone deacetylases (HDACs) has experienced a remarkable surge in recent
years. These enzymes are key regulators of several fundamental biological processes, often …