Design, Synthesis, and Biological Activity of NCC149 Derivatives as Histone Deacetylase 8??Selective Inhibitors

…, H Nakagawa, S Iida, K Shirahige, N Miyata

Index: Suzuki, Takayoshi; Muto, Nobusuke; Bando, Masashige; Itoh, Yukihiro; Masaki, Ayako; Ri, Masaki; Ota, Yosuke; Nakagawa, Hidehiko; Iida, Shinsuke; Shirahige, Katsuhiko; Miyata, Naoki ChemMedChem, 2014 , vol. 9, # 3 p. 657 - 664

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Citation Number: 15

Abstract

Design The molecular model of NCC149 (7) docked into the HDAC8 catalytic core suggested that the triazole ring interacts with the methylene group of HDAC8 Phe 152 through CH-π or hydrophobic interactions 15b (Figure 2). The triazole ring is also considered to be important in fixing the orientation of the zinc-binding hydroxamate and the hydrophobic pocket-binding phenylthiomethyl group appropriately, thereby contributing to ...