Deng, Yuqing; Peng, Jianzhao; Xiong, Feng; Song, Yinan; Zhou, Yu; Zhang, Jianfu; Lam, Fong Sang; Xie, Chao; Shen, Wenyin; Huang, Yiran; Meng, Ling; Li, Xiaoyu published the artcile< Selection of DNA-Encoded Dynamic Chemical Libraries for Direct Inhibitor Discovery>, Computed Properties of 180181-05-9, the main research area is DNA dynamics library inhibitor discovery; DNA; DNA-encoded dynamic libraries; drug discovery; dynamic combinatorial libraries; high-throughput screening.
Dynamic combinatorial libraries (DCLs) is a powerful tool for ligand discovery in biomedical research; however, the application of DCLs has been hampered by their low diversity. Recently, the concept of DNA encoding has been employed in DCLs to create DNA-encoded dynamic libraries (DEDLs); however, all current DEDLs are limited to fragment identification, and a challenging process of fragment linking is required after selection. The authors report an anchor-directed DEDL approach that can identify full ligand structures from large-scale DEDLs. This method is also able to convert unbiased libraries into focused ones targeting specific protein classes. The authors demonstrated this method by selecting DEDLs against five proteins, and novel inhibitors were identified for all targets. Notably, several selective BD1/BD2 inhibitors were identified from the selections against bromodomain 4 (BRD4), an important anti-cancer drug target. This work may provide a broadly applicable method for inhibitor discovery.
Angewandte Chemie, International Edition published new progress about Antitumor agents. 180181-05-9 belongs to class piperidines, and the molecular formula is C22H23NO4, Computed Properties of 180181-05-9.
Referemce:
Piperidine – Wikipedia,
Piperidine | C5H11N – PubChem