Drug repurposing targeting COVID-19 3CL protease using molecular docking and machine learning regression approaches. [PDF]
Aqeel I, Majid A, Albanyan A, Wasfi H.
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BSN suppresses the cell viability of colorectal cancer by inducing GPX4‐regulated ferroptosis. BSN may bind to NRF2 protein to inactivate the NRF2 signaling, inhibiting the expression of p62 and HO‐1. Abstract Background Indole phytoalexins, plant‐derived compounds present in cruciferous vegetables, have demonstrated anticancer properties.
Shi‐Yuan Wen+5 more
wiley +1 more source
Immunotoxicity Study of Cucurbit[n]urils (n = 6, 7, 8) and Modeling of Interaction with Some Monocyte Receptors by a Molecular Docking Method. [PDF]
Zhautikova SB+9 more
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In a study combining network pharmacological analysis and experimental verification, yunweiling has been shown improve functional constipation by inhibiting the PI3K‐Akt‐p53 signaling pathway and reducing the expression of TP53. Abstract Background This study investigated the impacts and mechanisms of yunweiling in the management of Functional ...
Peng Zhang+6 more
wiley +1 more source
Identification of Novel HPK1 Hit Inhibitors: From In Silico Design to In Vitro Validation. [PDF]
Isawi IH+3 more
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The flowchart of this research. Abstract Background Dry eye disease (DED) predominantly results from elevated tear film osmolarity, which can not only cause ocular inconvenience but may lead to visual impairments, severely compromising patient well‐being and exerting substantial economic burdens as well.
Ziyu Liu+9 more
wiley +1 more source
Investigation of the inhibitory potential of secondary metabolites isolated from Fernandoa adenophylla against Beta-glucuronidase via molecular docking and molecular dynamics simulation studies. [PDF]
Rauf A+11 more
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Mechanistic insights into Sanbi Decoction for osteoarthritis treatment based on network pharmacology and experimental validation. [PDF]
Huang Z+6 more
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Combining kinetics and in silico approaches to evaluate bromhexine as an anti-pancreatic lipase agent for obesity management. [PDF]
Gholami A, Minai-Tehrani D, Eriksson LA.
europepmc +1 more source
Exploration of Liuwei Dihuang Pill on periodontitis based on network pharmacology and molecular docking. [PDF]
Luo Y+5 more
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