ARTICLE TITLE: Molecular modeling studies on 11 beta-aminoethoxyphenyl and 7 alpha-aminoethoxyphenyl estradiols. Evidence suggesting a common hydrophobic pocket in estrogen receptor.

ARTICLE AUTHOR: Poupaert-JH; Lambert-DM; Vamecq-J; AbulHajj-YJ

REPRINT AUTHOR: AbulHajj, YJ; UNIV CATHOLIQUE LOUVAIN; ECOLE PHARM; BRUSSELS; BELGIUM

SOURCE: BIOORGANIC-AND-MEDICINAL-CHEMISTRY-LETTERS. APR 20 1995; 5 (8) : 839-842

ABSTRACT:

Molecular modeling studies were performed on 11 beta and 7 alpha-aminoethoxyphenyl estradiols to determine whether these compounds may interact with the same receptor subsite. Energy minimization and molecular dynamics studies lend support to this hypothesis.