fimasartan has been researched along with diphenyl* in 1 studies
1 other study(ies) available for fimasartan and diphenyl
Article | Year |
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Development of 3D-QSAR CoMSIA models for 5-(biphenyl-2-yl)-1H-tetrazole derivatives as angiotensin II receptor type 1 (AT1) antagonists.
As a development strategy for backups of Fimasartan (1), a comparative molecular similarity indices analysis (CoMSIA) of a set of sixty-five 5-(biphenyl-2-yl)-1H-tetrazole derivatives has been performed to find out the pharmacophore elements for angiotensin II receptor type 1 (AT1) blockade. The most potent compound containing pyrimidin-4(3H)-one ring, Fimasartan (1) was used to align the molecules. As a result, we obtained 3D-QSAR model which provided good predictivity for both the training set (q(2)=0.846, r(2)=0.975) and the external test set (rpred(2)=0.980). This model would guide the design of backups for Fimasartan (1), a launched oral antihypertensive agent. Topics: Angiotensin II Type 2 Receptor Blockers; Biphenyl Compounds; Computer Simulation; Inhibitory Concentration 50; Models, Chemical; Pyrimidines; Quantitative Structure-Activity Relationship; Tetrazoles | 2013 |