Virtual screening identification of novel chemical inhibitors for aberrant interactions between pathogenic mutant SOD1 and tubulin

K Hirayama, Y Fujiwara, T Terada, K Shimizu… - Neurochemistry …, 2019 - Elsevier
Amyotrophic lateral sclerosis (ALS) is a lethal neurodegenerative disease caused by
selective motor neuron death. Mutations in the gene encoding copper/zinc superoxide …

Comprehensive Analysis and Large-Scale Screening of Binding Interactions Between PFAS and Their Mixtures with Nuclear Receptors

S Roy, K Danasekaran, J Moran, K O'Brien… - 2024 - preprints.org
Perfluoroalkyl and polyfluoroalkyl substances (PFAS) are persistent environmental
contaminants of emerging concern, recognized for their toxicity and potential carcinogenic …

[引用][C] Development of novel analgesics: targeting the RNA-binding protein HuR

BP Joseph - 2024 - Dissertation, RWTH Aachen …

Exploring the therapeutic potential of cinnamon and clove essential oils for mitigating foodborne diseases: bioactivity and molecular interactions

RJ Pranav, SS Kumar, PR Rangaraj… - Food Science and …, 2024 - ijfsab.com
Foodborne diseases remain a global concern due to their widespread impact on public
health. Contaminated food can lead to outbreaks of illness that affect millions of people each …

[PDF][PDF] RSC Chemical Biology

XZ Zhao - 2023 - pdfs.semanticscholar.org
Tyrosyl-DNA phosphodiesterase 1 (TDP1) is a member of the phospholipase D family that
can downregulate the anticancer effects of the type I topoisomerase (TOP1) inhibitors by …

Visual-analytics-driven bioinformatics methods for the analysis of biomolecular data

S Kaur - 2022 - unsworks.unsw.edu.au
Continuous technological advances in molecular biology data collection, leading to the
accumulation of large amounts of diverse data, necessitate the need for novel and …

Correlation of binding site properties with chemistries used for generation of ultra-large virtual libraries.

R Song, M Nicklaus, N Tarasova - 2023 - chemrxiv.org
Although the size of virtual libraries of synthesizable compounds is growing rapidly, we are
still enumerating only tiny fractions of the drug-like chemical universe. At the same time, our …

[引用][C] Siyuan Song1, 2, 3, Jiayu Zhou1, 2, 3, Ye Li1, 2, 3, Jiatong Liu1, 2, Jingzhan Li1, 2, 3 & Peng Shu1, 2, 3Ε

ARA Radix, AFA Fructus, DL Drug-likeness - Scientific Reports, 2022

Identificación de posibles dianas terapéuticas en Alzheimer utilizando pipeline bioinformático combinado para aplicarlas al diseño de fármacos asistidos por …

LL Barriga Sanchez - 2023 - repositorio.uta.edu.ec
El acoplamiento molecular demostró que Estradiol y Tricostatina A pueden generar una
inhibición de la proteína CCND1, mientras que Dorsomorfina induce la inhibición de CDK6 …

[PDF][PDF] Design of Novel Selective Estrogen Receptor Inhibitors using Molecular Docking and Protein-Ligand Interaction Fingerprint Studies

G Rajitha, MV Rani, UN Vankadoth, A Umamaheswari - 2021 - researchgate.net
Aims: The genomic and non-genomic actions of human estrogen receptor α (hERα) play a
crucial role in breast epithelial cell proliferation and survival, as well as mammary …