Laboratorio di Chimica Bioinorganica, Polo Scientifico, Università degli Studi di Firenze, Room 188, Via della Lastruccia 3, 50019 Sesto Fiorentino, Florence, Italy.
J Med Chem. 2012 Feb 23;55(4):1721-30. doi: 10.1021/jm300031j. Epub 2012 Feb 13.
A series of dithiocarbamates were prepared by reaction of primary/secondary amines with carbon disulfide in the presence of bases. These compounds were tested for the inhibition of four human (h) isoforms of the zinc enzyme carbonic anhydrase, CA (EC 4.2.1.1), hCA I, II, IX, and XII, involved in pathologies such as glaucoma (CA II and XII) or cancer (CA IX). Several low nanomolar inhibitors targeting these CAs were detected. The X-ray crystal structure of the hCA II adduct with morpholine dithiocarbamate evidenced the inhibition mechanism of these compounds, which coordinate to the metal ion through a sulfur atom from the dithiocarbamate zinc-binding function. Some dithiocarbamates showed an effective intraocular pressure lowering activity in an animal model of glucoma.
一系列二硫代氨基甲酸盐是通过伯/仲胺与二硫化碳在碱存在下反应制备的。这些化合物被测试了对四种人类(h)同工型锌酶碳酸酐酶(CA)(EC 4.2.1.1)的抑制作用,包括与青光眼(CA II 和 XII)或癌症(CA IX)等疾病相关的 hCA I、II、IX 和 XII。检测到了几种针对这些 CA 的低纳摩尔抑制剂。与吗啉二硫代氨基甲酸盐的 hCA II 加合物的 X 射线晶体结构证明了这些化合物的抑制机制,它们通过二硫代氨基甲酸盐的锌结合功能中的一个硫原子与金属离子配位。一些二硫代氨基甲酸盐在青光眼动物模型中显示出有效的眼压降低活性。