Université de Toulouse III, UPS, PHARMA-DEV, UMR 152, 118 Route de Narbonne, F-31062 Toulouse cedex 9, France; IRD, UMR 152, F-31062 Toulouse cedex 9, France.
Université de Toulouse III, UPS, PHARMA-DEV, UMR 152, 118 Route de Narbonne, F-31062 Toulouse cedex 9, France; IRD, UMR 152, F-31062 Toulouse cedex 9, France.
Eur J Med Chem. 2014 Apr 9;76:369-75. doi: 10.1016/j.ejmech.2014.02.038. Epub 2014 Feb 14.
There is an urgent need for new antimalarial drugs with novel mechanisms of action on novel targets. Indolone-N-oxides (INODs) display antimalarial properties in vitro and in vivo, but identified leads such as 6-(4-chloro-phenyl)-5-oxy-[1,3]dioxolo[4,5-f]indol-7-one 1, suffer from very poor aqueous solubility. In this study, structural modifications have been made by introducing various amino and bulky groups to produce sufficiently water soluble and active compounds for further pharmacological and pharmacokinetic studies. We report here the preparation of twelve novel amino derivatives and their antiplasmodial activities including those of two other structurally known compounds. The 5-methoxy-2-(4-morpholin-4-yl-phenyl)-1-oxy-indol-3-one, 9, has the highest antiplasmodial activity in vitro (IC₅₀ = 6.5 nM; FcB1 strain) and selectivity index (SI (CC₅₀ MCF7/IC₅₀ FcB1) = 4538.5). The 6-amino-2-(4-chloro-phenyl)-1-oxy-indol-3-one, 14, (IC₅₀ = 183 nM; SI = 60), is an excellent candidate for further mechanistic studies. Indeed, this is structurally the closest analogue to the current lead, 1, bearing an NH2 group at R(2) offering possibilities for functionalization and labeling.
迫切需要具有新型作用机制和新型靶点的新型抗疟药物。哚啉-N-氧化物(INODs)在体外和体内均表现出抗疟特性,但已鉴定的先导化合物,如 6-(4-氯苯基)-5-氧-[1,3]二氧杂环[4,5-f]吲哚-7-酮 1,其水溶性非常差。在这项研究中,通过引入各种氨基和大体积基团进行结构修饰,得到了足够水溶性和活性的化合物,以进行进一步的药理学和药代动力学研究。我们在此报告了十二种新型氨基衍生物的制备及其抗疟活性,包括两种其他结构已知的化合物。5-甲氧基-2-(4-吗啉-4-基-苯基)-1-氧吲哚-3-酮 9 具有最高的体外抗疟活性(IC₅₀ = 6.5 nM;FcB1 株)和选择性指数(SI(CC₅₀ MCF7/IC₅₀ FcB1)= 4538.5)。6-氨基-2-(4-氯苯基)-1-氧吲哚-3-酮 14(IC₅₀ = 183 nM;SI = 60)是进一步进行机制研究的优秀候选者。事实上,这是与当前先导化合物 1 结构最接近的类似物,在 R(2)位上带有一个 NH2 基团,为功能化和标记提供了可能性。