Bisarylureas Based on 1H-Pyrazolo[3,4-d]pyrimidine Scaffold as Novel Pan-RAF Inhibitors with Potent Anti-Proliferative Activities: Structure-Based Design, Synthesis, Biological Evaluation and Molecular Modelling Studies.

Fu, Yu; Wang, Yuanyuan; Wan, Shanhe; Li, Zhonghuang; Wang, Guangfa; Zhang, Jiajie; Wu, Xiaoyun

Fu, Yu; Wang, Yuanyuan; Wan, Shanhe; Li, Zhonghuang; Wang, Guangfa; Zhang, Jiajie; Wu, Xiaoyun.

Affiliation

Fu Y; Guangdong Provincial Key Laboratory of New Drug Screening, School of Pharmaceutical Science, Southern Medical University, Guangzhou 510515, China. fuyuky0312@163.com.
Wang Y; Guangdong Provincial Key Laboratory of New Drug Screening, School of Pharmaceutical Science, Southern Medical University, Guangzhou 510515, China. 15626047153@163.com.
Wan S; Guangdong Provincial Key Laboratory of New Drug Screening, School of Pharmaceutical Science, Southern Medical University, Guangzhou 510515, China. wansh@fimmu.com.
Li Z; Guangdong Provincial Key Laboratory of New Drug Screening, School of Pharmaceutical Science, Southern Medical University, Guangzhou 510515, China. lzhuang@fimmu.com.
Wang G; Guangdong Provincial Key Laboratory of New Drug Screening, School of Pharmaceutical Science, Southern Medical University, Guangzhou 510515, China. wguangfa@smu.edu.cn.
Zhang J; Guangdong Provincial Key Laboratory of New Drug Screening, School of Pharmaceutical Science, Southern Medical University, Guangzhou 510515, China. zhangjj@smu.edu.cn.
Wu X; Guangdong Provincial Key Laboratory of New Drug Screening, School of Pharmaceutical Science, Southern Medical University, Guangzhou 510515, China. xywugz@163.com.

Molecules ; 22(4)2017 Mar 29.

Article in En | MEDLINE | ID: mdl-28353640

Subject(s)

Protein Kinase Inhibitors/chemical synthesis; Proto-Oncogene Proteins B-raf/antagonists & inhibitors; Pyrimidines/chemical synthesis; Pyrimidines/pharmacology; A549 Cells; Cell Cycle/drug effects; Cell Line, Tumor; Cell Proliferation/drug effects; Drug Design; Drug Screening Assays, Antitumor; HT29 Cells; Humans; Models, Molecular; Protein Kinase Inhibitors/chemistry; Protein Kinase Inhibitors/pharmacology; Proto-Oncogene Proteins B-raf/chemistry; Pyrimidines/chemistry; Structure-Activity Relationship

Key words

1H-pyrazolo[3,4-d]pyrimidine derivatives; DFG-out; biological activities; molecular docking; molecular dynamics simulation; pan-RAF inhibitor

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Full text: 1 Collection: 01-internacional Database: MEDLINE Main subject: Pyrimidines / Proto-Oncogene Proteins B-raf / Protein Kinase Inhibitors Type of study: Prognostic_studies Limits: Humans Language: En Journal: Molecules Journal subject: BIOLOGIA Year: 2017 Type: Article Affiliation country: China

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