Network-Wide Screen Identifies Variation of Novel Precise On-Module Targets Using Conformational Modudaoism

Abstract

In summary, the MD-based method is effective in quantitatively discriminating between the CAMs and UAMs in multiple network comparison. The UAMs of BA, JA, and UA identified by MDc/MDv values revealed their divergent and characteristic actions in treating cerebral ischemia, such as negative regulation of nitrogen metabolism and Wnt signaling pathways of BA, magnesium ions binding and the progesterone-mediated oocyte maturation pathway of JA, and regulation of cell organization, organ organization, and cell cycle of UA. This MD-based modular analysis may provide a unique and promising strategy for pharmacological research and development.