Chowdhury S F, Di Lucrezia R, Guerrero R H, Brun R, Goodman J, Ruiz-Perez L M, Pacanowska D G, Gilbert I H
Welsh School of Pharmacy, Cardiff University, UK.
Bioorg Med Chem Lett. 2001 Apr 23;11(8):977-80. doi: 10.1016/s0960-894x(01)00089-0.
The program DOCK3.5 was used to search the Cambridge Structural Database for novel inhibitors of Leishmanial dihydrofolate reductase. A number of compounds were obtained and screened against the enzyme and against the intact parasite Leishmania donovani and the related organisms Trypanosoma brucei and Trypanosoma cruzi. The compounds screened showed weak activity in both the enzyme assays and the in vitro assays.
使用程序DOCK3.5在剑桥结构数据库中搜索利什曼原虫二氢叶酸还原酶的新型抑制剂。获得了许多化合物，并针对该酶、完整的杜氏利什曼原虫以及相关生物体布氏锥虫和克氏锥虫进行了筛选。所筛选的化合物在酶分析和体外分析中均显示出较弱的活性。
