Gains from no real PAINS: Where 'Fair Trial Strategy' stands in the development of multi-target ligands.
第一作者:
Jianbo,Sun
第一单位:
State Key Laboratory of Natural Medicines, Department of Natural Medicinal Chemistry, School of Traditional Chinese Pharmacy, China Pharmaceutical University, Nanjing 210009, China.
作者:
关键词
AD, Alzheimer diseaseALARM NMR, a La assay to detect reactive molecules by nuclear magnetic resonanceBiochemical experimentCADD, computer-aided drug design technologyCoA, coenzyme AEGFR, epidermal growth factor receptorFair trial strategyGSH, glutathioneHER2, human epidermal growth factor receptor 2HTS, high-throughput screeningIn silico filteringLC?MS, liquid chromatography?mass spectrometryMTDLs, multitarget-directed ligandsMultitarget-directed ligandsPAINS suspectsPAINS, pan-assay interference compoundsQSAR, quantitative structure–activity relationshipROS, radicals and oxygen reactive species
DOI
10.1016/j.apsb.2021.02.023
PMID
34900527
发布时间
2024-04-04
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Acta pharmaceutica Sinica. B
2021年11卷11期
3417-3432页
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