Colorectal cancer is one of the most common cancers worldwide, and it is also one of the major causes of mortality from cancer. Chemotherapy drugs are generally limited due to various complications, as well as the development of resistance and recurrence. The in silico docking investigation involved exploration of protein or nucleotide, 3D structural modeling, molecular docking, and binding energy calculation. Protein-protein interactions are significant to many biological processes, and their disruption is a leading cause of disease. The use of small molecules to modulate them is gaining popularity, but protein interfaces usually lack specific cavities for processing small molecules. MMP-2, PARP, iNOS, Chk1, proteins were used in the molecular docking analysis of kaempferitrin and 5-flurouracil. The compound kaempferitrin had the highest binding energy scores with most of the target proteins, according to molecular docking results. The findings suggest it could be used to develop new drugs for cancer therapy.

结直肠癌是全球最常见的癌症之一，也是癌症死亡的主要原因之一。由于各种并发症，以及耐药性和复发的发展，化疗药物通常受到限制。将在硅片对接研究涉及蛋白质或核苷酸的探索、3D 结构建模、分子对接和结合能计算。蛋白质-蛋白质相互作用对许多生物过程很重要，它们的破坏是导致疾病的主要原因。使用小分子来调节它们越来越受欢迎，但蛋白质界面通常缺乏用于处理小分子的特定腔。MMP-2、PARP、iNOS、Chk1、蛋白质用于山奈酚和5-氟尿嘧啶的分子对接分析。根据分子对接结果，化合物山奈酚与大多数靶蛋白的结合能得分最高。研究结果表明，它可用于开发新的癌症治疗药物。