Title:
DRUG MOLECULE PROCESSING METHOD AND APPARATUS BASED ON ARTIFICIAL INTELLIGENCE, AND DEVICE, STORAGE MEDIUM AND COMPUTER PROGRAM PRODUCT
Document Type and Number:
WIPO Patent Application WO/2022/161323
Kind Code:
A1
Abstract:
A drug molecule processing method and apparatus based on artificial intelligence, and an electronic device, a computer-readable storage medium and a computer program product, which relate to artificial intelligence technology. The method comprises: determining multiple candidate drug molecules for a target protein; performing activity prediction processing on the basis of the multiple candidate drug molecules and the target protein to obtain activity information of each candidate drug molecule; performing homology modeling processing on the target protein to obtain a reference protein having a homologous structure to the target protein; performing molecular docking processing on the basis of the reference protein and the multiple candidate drug molecules to obtain molecular docking information of each candidate drug molecule; and performing screening processing on the multiple candidate drug molecules on the basis of the activity information of each candidate drug molecule and the molecular docking information of each candidate drug molecule to obtain a target drug molecule for the target protein.
Inventors:
YU YANG (CN)
ZHENG LIANGZHEN (CN)
LIU YIXUAN (CN)
ZHENG LIANGZHEN (CN)
LIU YIXUAN (CN)
Application Number:
PCT/CN2022/073558
Publication Date:
August 04, 2022
Filing Date:
January 24, 2022
Export Citation:
Assignee:
TENCENT TECH SHENZHEN CO LTD (CN)
International Classes:
G16C20/50
Domestic Patent References:
| WO2017062382A1 | 2017-04-13 |
Foreign References:
| CN112201313A | 2021-01-08 | |||
| CN105765592A | 2016-07-13 | |||
| CN109872771A | 2019-06-11 | |||
| US20130184462A1 | 2013-07-18 | |||
| CN202110119170A | 2021-01-28 |
Attorney, Agent or Firm:
CHINA PAT INTELLECTUAL PROPERTY OFFICE (CN)
Download PDF:
Previous Patent: HOT AIR DEVICE FOR DISH-WASHING MACHINE AND DISH-WASHING MACHINE
Next Patent: WORKING STATE DETERMINATION METHOD AND DEVICE
Next Patent: WORKING STATE DETERMINATION METHOD AND DEVICE