Structural and Activity Profile Relationships Between Drug Scaffolds

  title={Structural and Activity Profile Relationships Between Drug Scaffolds},
  author={Ye Hu and J{\"u}rgen Bajorath},
  journal={The AAPS Journal},
Core structures of current drugs have been assembled and their structural relationships and activity profiles have been explored. Drug scaffolds were frequently involved in different types of structural relationships. In addition, a variety of activity profile relationships between structurally related drug scaffolds were detected, ranging from closely overlapping to distinct profiles. Furthermore, when structural and activity profile relationships of scaffolds from drugs and bioactive… CONTINUE READING