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3D structure of OCT1-3 proteins had been predicted by considering the structures and function of these proteins. We predicted useful regions (active and ligand binding internet sites) of OCT1-3 and performed comparative bioinformatics analysis. The predicted structure of hOCT1-3 was then reviewed in the Blind Docking host and the outcomes had been confirmed with predicted binding website deposits and conserved domain regions. We simulated the OCT1-3 and metfo