AI Medical Compendium Topic

Explore the latest research on artificial intelligence and machine learning in medicine.

Cyclooxygenase 2

Showing 1 to 9 of 9 articles

Clear Filters

Specialized oxygenated heterocyclics from Villorita cyprinoides with cyclooxygenase-2 and 5-lipoxygenase inhibitory properties.

Food research international (Ottawa, Ont.) 29579915
Villorita cyprinoides is traditional seafood in the coastal regions of Arabian Sea. Bioactivity-guided purification of ethyl acetate:methanol extract of V. cyprinoides resulted in the identification of two O-spirocyclic ether derivatives (1-2) along ...
Animals Antioxidants Arachidonate 5-Lipoxygenase Biological Products Bivalvia Cyclooxygenase 2 Cyclooxygenase 2 Inhibitors Humans Lipoxygenase Lipoxygenase Inhibitors Molecular Docking Simulation Molecular Structure Oxygen Seafood Structure-Activity Relationship
View on PubMed DOI

Candida albicans-derived mannoproteins activate NF-κB in reporter cells expressing TLR4, MD2 and CD14.

PloS one 29281684
The ability of soluble C. albicans 20A (serotype A) mannoprotein (CMP) to serve as a ligand for toll-like receptor 4 (TLR4) and its co-receptors was examined using commercially available and stably-transfected HEK293 cells that express human TLR4, MD...
Candida albicans Cyclooxygenase 2 Glycosylation HEK293 Cells Humans Interleukin-8 Lipopolysaccharide Receptors Lipopolysaccharides Lymphocyte Antigen 96 Membrane Glycoproteins NF-kappa B Toll-Like Receptor 4 Transcription, Genetic Tumor Necrosis Factor-alpha
View on PubMed DOI

Achyranthes bidentate saponins protect rat articular chondrocytes against interleukin-1β-induced inflammation and apoptosis in vitro.

The Kaohsiung journal of medical sciences 28137413
Achyranthes bidentate Blume (Niuxi) is often employed for treatment of arthritis in Traditional Chinese Medicine and possesses anti-inflammatory properties. Phytochemical and pharmacological studies proved the oleanane-type saponins to be the main bi...
Achyranthes Animals Anti-Inflammatory Agents, Non-Steroidal Apoptosis bcl-2-Associated X Protein bcl-Associated Death Protein bcl-X Protein Cartilage, Articular Caspase 3 Chondrocytes Cyclooxygenase 2 Gene Expression Regulation Inflammation Interleukin-1beta Male Matrix Metalloproteinase 3 Matrix Metalloproteinase 9 NF-kappa B Plant Extracts Plant Roots Primary Cell Culture Proliferating Cell Nuclear Antigen Rats Rats, Sprague-Dawley Saponins Signal Transduction Tumor Suppressor Protein p53
View on PubMed DOI

[Mechanism of Musk and Borneol on Inflammatory of Cerebral Ischemia and Reperfusion Injury at Different Time Points of Acute Phase in Rats].

Zhong yao cai = Zhongyaocai = Journal of Chinese medicinal materials 27254931
OBJECTIVE: To investigate the mechanism of Musk and Borneol on cerebral ischemia and reperfusion injury at different time points of acute phase in rats.
Animals Anti-Inflammatory Agents Arachidonate 5-Lipoxygenase Brain Brain Ischemia Camphanes Cyclooxygenase 2 Fatty Acids, Monounsaturated Rats Rats, Sprague-Dawley Reperfusion Injury
View on PubMed

The study of dual COX-2/5-LOX inhibitors by using electronic-topological approach based on data on the ligand-receptor interactions.

Journal of molecular graphics & modelling 26117823
Structural and electronic factors influencing selective inhibition of cyclooxygenase-2 and 5-lipoxygenase (COX-2/5-LOX) were studied by using Electronic-Topological Method combined with Neural Networks (ETM-NN), molecular docking, and Density Functio...
Algorithms Arachidonate 5-Lipoxygenase Catalytic Domain Cyclooxygenase 2 Cyclooxygenase 2 Inhibitors Datasets as Topic Humans Ligands Lipoxygenase Inhibitors Molecular Docking Simulation Molecular Structure Neural Networks, Computer Protein Binding Quantum Theory Structure-Activity Relationship Substrate Specificity
View on PubMed DOI

Virtual screening and invitro evaluation of cyclooxygenase inhibitors from using the machine learning tool.

Journal of biomolecular structure & dynamics 37904339
has a variety of compounds, and some of these compounds may have anti-inflammatory and antioxidant properties. In the present study, we identified the compounds in the leaf extract of through Gas Chromatography-Mass Spectrometry (GC-MS) analysis an...
Cyclooxygenase 1 Cyclooxygenase 2 Cyclooxygenase Inhibitors Humans Hydrogen Bonding Machine Learning Molecular Docking Simulation Molecular Dynamics Simulation Plant Extracts Tinospora
View on PubMed DOI

Explainable artificial intelligence-assisted virtual screening and bioinformatics approaches for effective bioactivity prediction of phenolic cyclooxygenase-2 (COX-2) inhibitors using PubChem molecular fingerprints.

Molecular diversity 38200203
Cyclooxygenase-2 (COX-2) inhibitors are nonsteroidal anti-inflammatory drugs that treat inflammation, pain and fever. This study determined the interaction mechanisms of COX-2 inhibitors and the molecular properties needed to design new drug candidat...
Artificial Intelligence Computational Biology Cyclooxygenase 2 Cyclooxygenase 2 Inhibitors Hydrophobic and Hydrophilic Interactions Ligands Machine Learning Molecular Docking Simulation Molecular Dynamics Simulation Phenols
View on PubMed DOI

COX-2 Inhibitor Prediction With KNIME: A Codeless Automated Machine Learning-Based Virtual Screening Workflow.

Journal of computational chemistry 39797538
Cyclooxygenase-2 (COX-2) is an enzyme that plays a crucial role in inflammation by converting arachidonic acid into prostaglandins. The overexpression of enzyme is associated with conditions such as cancer, arthritis, and Alzheimer's disease (AD), wh...
Cyclooxygenase 2 Cyclooxygenase 2 Inhibitors Drug Evaluation, Preclinical Humans Machine Learning Molecular Structure Workflow
View on PubMed DOI

Modeling Enzyme Reaction and Mutation by Direct Machine Learning/Molecular Mechanics Simulations.

Journal of chemical theory and computation 40273117
Accurately modeling enzyme reactions through direct machine learning/molecular mechanics simulations remains challenging in describing the electrostatic coupling between the QM and MM subsystems. In this work, we proposed a reweighting ME (mechanic e...
Acylation Aspirin Cyclooxygenase 1 Cyclooxygenase 2 Humans Machine Learning Molecular Dynamics Simulation Mutation Static Electricity Thermodynamics
View on PubMed DOI
Popular Topics
Recent Journals