In Silico Research in Biomedicine
Computational investigation of predicted phytochemical interactions and simulated structural behavior with estrogen receptor-α from
By Omeyiza Micheal Ibrahim, Olawale Rasaq Ajuwon, Temitope Olawale Jeje and 5 others.
Abstract
Background
Breast cancer remains a major global health concern, and bioprospecting bioactive phytochemicals from Newbouldia laevis may provide potential lead compounds for addressing persistent treatment challenges. This study aimed to identify N. laevis phytochemicals with favorable predicted interaction patterns with estrogen receptor-α (ESR1) for further investigation in estrogen receptor-positive breast cancer.