Design, Synthesis and Molecular Docking Study of 6,7-Dioxo-4-aryl-aminocoumarin
文献类型：期刊论文
| 作者 | Wang Ailing1,2; Tao Bo1; Ai Chunzhi3; Zheng Xuefeng2 |
| 刊名 | chinese journal of organic chemistry
 |
| 出版日期 | 2015-04-01 |
| 卷号 | 35期号:4页码:843-850 |
| 关键词 | coumarin COMT inhibitor L-dopa SAR Parkinson's disease |
| 英文摘要 | catechol-o-methyltransferase (comt) inhibitors play an important role in the treatment of parkinson's disease (pd). on the basis of the structure-activity relation (sar) analysis of existing comt inhibitors, entacapone and tolcapone, it has been derived that coumarin compounds containing catechol structures may have inhibitory bioactivities on comt. thus, the novel comt inhibitors, 6,7-dioxo-4-arylaminocoumarin compounds, were designed, and their inhibitory bioactivities on comt were investigated by theoretical calculation. the results show that ten 6,7-dioxo-4-aryl-aminocoumarin compounds exhibit good docking effect, especially 6,7-bis(2-methoxyethoxy)-4-phenylamino-2h-chromen-2-one (6b4) and 4-(3-ethynylphenyl)amino-6,7-bis(2-methoxyethoxy)-2h-chromen-2-one (6b5) which have the structure of catechol protected by methoxy ethyl group. |
| WOS标题词 | science & technology ; physical sciences |
| 类目[WOS] | chemistry, organic |
| 研究领域[WOS] | chemistry |
| 关键词[WOS] | catechol-o-methyltransferase ; biological evaluation ; inhibitors ; pharmacokinetics ; derivatives ; opicapone ; levodopa ; disease |
| 收录类别 | SCI |
| 语种 | 英语 |
| WOS记录号 | WOS:000355964200010 |
| 公开日期 | 2016-05-09 |
| 源URL | [http://cas-ir.dicp.ac.cn/handle/321008/146306]  |
| 专题 | 大连化学物理研究所_中国科学院大连化学物理研究所 |
| 作者单位 | 1.Northeast Agr Univ, Coll Agron, Harbin 150030, Peoples R China 2.Dalian Univ, Liaoning Key Lab Bioorgan Chem, Dalian 116622, Peoples R China 3.Chinese Acad Sci, Dalian Inst Chem Phys, Lab Pharmaceut Resource Discovery, Dalian 116023, Peoples R China |
| 推荐引用方式 GB/T 7714 | Wang Ailing,Tao Bo,Ai Chunzhi,et al. Design, Synthesis and Molecular Docking Study of 6,7-Dioxo-4-aryl-aminocoumarin[J]. chinese journal of organic chemistry,2015,35(4):843-850. |
| APA | Wang Ailing,Tao Bo,Ai Chunzhi,&Zheng Xuefeng.(2015).Design, Synthesis and Molecular Docking Study of 6,7-Dioxo-4-aryl-aminocoumarin.chinese journal of organic chemistry,35(4),843-850. |
| MLA | Wang Ailing,et al."Design, Synthesis and Molecular Docking Study of 6,7-Dioxo-4-aryl-aminocoumarin".chinese journal of organic chemistry 35.4(2015):843-850. |
入库方式： OAI收割
来源：大连化学物理研究所
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