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Dihydroorotate Dehydrogenase

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A Novel Graph Neural Network Methodology to Investigate Dihydroorotate Dehydrogenase Inhibitors in Small Cell Lung Cancer.

Biomolecules 33806898
Small cell lung cancer (SCLC) is a particularly aggressive tumor subtype, and dihydroorotate dehydrogenase (DHODH) has been demonstrated to be a therapeutic target for SCLC. Network pharmacology analysis and virtual screening were utilized to find ou...
Algorithms Dihydroorotate Dehydrogenase Humans Machine Learning Molecular Docking Simulation Neural Networks, Computer Oxidoreductases Acting on CH-CH Group Donors Small Cell Lung Carcinoma
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Development of a machine learning-based target-specific scoring function for structure-based binding affinity prediction for human dihydroorotate dehydrogenase inhibitors.

Journal of computational chemistry 39325045
Human dihydroorotate dehydrogenase (hDHODH) is a flavin mononucleotide-dependent enzyme that can limit de novo pyrimidine synthesis, making it a therapeutic target for diseases such as autoimmune disorders and cancer. In this study, using the docking...
Binding Sites Dihydroorotate Dehydrogenase Enzyme Inhibitors Humans Ligands Machine Learning Molecular Docking Simulation Molecular Dynamics Simulation Molecular Structure Oxidoreductases Acting on CH-CH Group Donors Protein Binding
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