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Beware of extreme calculated lipophilicity when designing cyclic peptides
Nature Chemical Biology ( IF 12.9 ) Pub Date : 2024-09-19 , DOI: 10.1038/s41589-024-01715-0 Vasanthanathan Poongavanam , Duc Duy Vo , Jan Kihlberg
Nature Chemical Biology ( IF 12.9 ) Pub Date : 2024-09-19 , DOI: 10.1038/s41589-024-01715-0 Vasanthanathan Poongavanam , Duc Duy Vo , Jan Kihlberg
Orally bioavailable, high molecular weight macrocyclic peptides that inhibit difficult-to-drug protein–protein interactions are of high therapeutic value, and rules for their design were proposed recently. Here, we emphasize the danger of rules that provide a false impression of the lipophilicity required of a clinical candidate.
中文翻译:
设计环肽时要注意极端计算的亲脂性
口服生物可利用的高分子量大环肽可抑制难以药物的蛋白质-蛋白质相互作用,具有很高的治疗价值,最近提出了其设计规则。在这里,我们强调规则的危险性,这些规则对临床候选人所需的亲脂性产生了错误的印象。
更新日期:2024-09-19
中文翻译:
设计环肽时要注意极端计算的亲脂性
口服生物可利用的高分子量大环肽可抑制难以药物的蛋白质-蛋白质相互作用,具有很高的治疗价值,最近提出了其设计规则。在这里,我们强调规则的危险性,这些规则对临床候选人所需的亲脂性产生了错误的印象。