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	Pharmacophore analysis of epidermal growth factor receptor tyrosine kinase inhibitors
	Peng, T; Pei, JF; Zhou, JJ
刊名	ACTA CHIMICA SINICA
	2003-03-01
卷号	61期号:3页码:430-434
关键词	pharmacophore EGFR tyrosine kinase inhibitor active site
ISSN号	0567-7351
其他题名	Acta Chim. Sin.
中文摘要	A three-dimensional pharmacophore of epidermal growth factor receptor tyrosine kinase inhibitors was obtained based upon 3D-QSAR of a series of these inhibitors. The result was accordant with the pharmacophore model given by the scientists at Novartis. The pharmacophore included a hydrogen bond receptor, a hydrogen bond donor, a hydrophobic area and a phenyl ring with a chlorine or a bromine atom. This pharmacophore is very useful for clarifying the structure-activity relationships of EGFR tyrosine kinase inhibitors. Some lead compounds may be acquired through dime-dimensional database searching.
英文摘要	A three-dimensional pharmacophore of epidermal growth factor receptor tyrosine kinase inhibitors was obtained based upon 3D-QSAR of a series of these inhibitors. The result was accordant with the pharmacophore model given by the scientists at Novartis. The pharmacophore included a hydrogen bond receptor, a hydrogen bond donor, a hydrophobic area and a phenyl ring with a chlorine or a bromine atom. This pharmacophore is very useful for clarifying the structure-activity relationships of EGFR tyrosine kinase inhibitors. Some lead compounds may be acquired through dime-dimensional database searching.
WOS标题词	Science & Technology ; Physical Sciences
类目[WOS]	Chemistry, Multidisciplinary
研究领域[WOS]	Chemistry
关键词[WOS]	DESIGN ; MODEL ; POTENT
收录类别	SCI
原文出处	://WOS:000182279800025
语种	英语
WOS记录号	WOS:000182279800025
公开日期	2013-11-08
内容类型	期刊论文
版本	出版稿
源URL	[http://ir.ipe.ac.cn/handle/122111/5322]
专题	过程工程研究所_研究所（批量导入）
作者单位	Chinese Acad Sci, Inst Proc Engn, Beijing 100080, Peoples R China
推荐引用方式 GB/T 7714	Peng, T,Pei, JF,Zhou, JJ. Pharmacophore analysis of epidermal growth factor receptor tyrosine kinase inhibitors[J]. ACTA CHIMICA SINICA,2003,61(3):430-434.
APA	Peng, T,Pei, JF,&Zhou, JJ.(2003).Pharmacophore analysis of epidermal growth factor receptor tyrosine kinase inhibitors.ACTA CHIMICA SINICA,61(3),430-434.
MLA	Peng, T,et al."Pharmacophore analysis of epidermal growth factor receptor tyrosine kinase inhibitors".ACTA CHIMICA SINICA 61.3(2003):430-434.

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