Combination of QSAR Modeling and Hybrid-Based Consensus Scoring to Identify Dual-Targeting Inhibitors of PLK1 and p38γ
Zixuan Cheng,
Siaw San Hwang,
Mrinal Bhave
et al.
Abstract:Polo-like kinase 1 (PLK1) and p38γ mitogen-activated protein kinase (p38γ) play important roles in cancer pathogenesis by controlling cell cycle progression and are therefore attractive cancer targets. The design of multitarget inhibitors may offer synergistic inhibition of distinct targets and reduce the risk of drug−drug interactions to improve the balance between therapeutic efficacy and safety. We combined deep-learning-based quantitative structure−activity relationship (QSAR) modeling and hybrid-based con… Show more
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