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Machine learning-based QSAR and structure-based virtual screening guided discovery of novel mIDH1 inhibitors from natural products

17 (4), 575586 viii

2 Kisseleva T, Brenner D

Jeong BC, Kim BS, Kim JI, Kim HH

10.1016/j.bbadis.2010.11.007 Biochim

Key mutations in genes such as C24SMT, C5DS, and C14DM lead to the loss of ergosterol and the accumulation of other sterol precursors, which reduce the binding affinity of AmB to the parasite membrane and decrease drug sensitivity (Mukherjee et al., 2020)