New Structure Descriptor in the Structure-Activity Relationship Study on the Suppression of Aryl Hydrocarbon Receptor Transformation by Anthraquinones

被引:0
|
作者
Kawase, Masaya [1 ]
Saito, Tadashi [2 ]
Yasunaga, Teruo [3 ]
Takagi, Tatsuya [4 ]
Fukuda, Itsuko [5 ]
Ashida, Hitoshi [5 ]
机构
[1] Nagahama Inst Biosci & Technol, Fac Biosci, Nagahama 5260829, Japan
[2] Osaka Univ, Radioisotope Res Ctr, Toyonaka, Osaka 5600042, Japan
[3] Osaka Univ, Genome Informat Res Ctr, Suita, Osaka 5650871, Japan
[4] Osaka Univ, Grad Sch Pharmaceut Sci, Suita, Osaka 5650871, Japan
[5] Kobe Univ, Grad Sch Agr Sci, Kobe, Hyogo 6578501, Japan
关键词
QSAR; new descriptor; anthraquinones; aryl hydrocarbon receptor; 2,3,7,8-tetrachlorodibenzo-p-dioxin; hepatocytes; 2,3,7,8-TETRACHLORODIBENZO-P-DIOXIN; QSAR;
D O I
10.3136/fstr.18.173
中图分类号
TS2 [食品工业];
学科分类号
0832 ;
摘要
A new descriptor showing the positions of functional groups in compounds with the same main backbone was developed. This descriptor was applied to the Quantitative Structure-Activity Relationship (QSAR) study on the suppression activities of anthraquinones via transformation of the aryl hydrogen receptor by 2,3,7,8-tetrachlorodibenzo-p-dioxin. It was shown that the newly developed descriptor played an important role in the QSAR study.
引用
收藏
页码:173 / 176
页数:4
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