Article

<em>Plasmodium falciparum</em> Dihydroorotate Dehydrogenase, Fragment-based Drug Design, 2D-QSAR, DFT Calculation, Lead Optimization, Induced Fit Docking

2021-12-20

Abstract excerpt

Plasmodium falciparum dihydroorotate dehydrogenase (PfDODH) is one of the enzymes currently explored in the treatment of malaria. Although there is currently no clinically approved drug targeting PfDODH, many of the compounds in clinical trials have [1, 2, 4,] triazolo [1, 5-a] pyrimidin-7-amine backbone structure. This study sought to design new compounds from the fragments of known experimental inhibitors of PfD...

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Literature Corpus work: 6b3e280d-6760-5225-b599-e4887ba2dc94
DOI: 10.20944/preprints202112.0296.v1

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