INTERACTION PREDICTION DEVICE, INTERACTION PREDICTION METHOD AND PROGRAM PRODUCT Russian patent published in 2017 - IPC C12M1/34 C12Q1/00 G06F19/16 C40B30/00 

FIELD: biochemistry.

SUBSTANCE: group of inventions relates to prediction of biomolecular binding. Disclosed is a method and an apparatus for predicting interaction between a compound and a protein, and energy-independent material of computer-readable data medium. Device includes a data storage unit and a control unit. Storage unit comprises a compound structure data storage unit and a protein structure data storage unit. Control unit comprises a compound structure data acquiring unit, protein structure data acquiring unit, a predicted protein determining unit and an interaction strength determining unit. Method includes a step of obtaining compound structure data, a step of obtaining protein structure data, a step of determining a predicted protein and a step of determining interaction strength. Data carrier comprises programmed commands to cause, upon execution thereof by apparatus, prediction of interaction.

EFFECT: inventions enable to efficiently identify a biomolecule, such as protein, in which a possible compound interacts in a living body.

8 cl, 16 dwg