QSAR Study of the Anti-Cancer Activity of 38 Compounds in Different Cancer Cell Lines Based on Gene Expression Programming

Abstract:

Using the GEP,the QSAR model for anti-cancer activity of 38 compounds in 5 cancer cell lines was establish. These compounds are a novel class of anticarcinogen named tricyclic 5:7:5-fused diimidazo [4, 5-d:4, 5-f ][1, diazepines. The carcinoma cell lines involved in this research are A549 lung cancer, MCF-7 breast cancer, MDA-MB-231 breast cancer, OVCAR-3 ovarian cancer and PC-3 prostate cancer. Accuracies of these models in training group and test group are over 90%, showing perfect predictive ability. This QSAR model will be great valuable in providing guidance for future designing and synthesizing of anticancer drugs.

• Periodical: Advanced Materials Research (Volumes 850-851)
• Pages: 1291-1294
• DOI: https://doi.org/10.4028/www.scientific.net/AMR.850-851.1291
• Online since: December 2013
• Authors: Xiu Rui Han, Xian Chao Li, Hong Zong Si, Cui Zhu Ge, Hua Gao, Hong Lin Zhai
• Keywords: Anticancer Activity, GEP, QSAR

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