JPWO2022149395A1 - - Google Patents
Info
- Publication number
- JPWO2022149395A1 JPWO2022149395A1 JP2022573954A JP2022573954A JPWO2022149395A1 JP WO2022149395 A1 JPWO2022149395 A1 JP WO2022149395A1 JP 2022573954 A JP2022573954 A JP 2022573954A JP 2022573954 A JP2022573954 A JP 2022573954A JP WO2022149395 A1 JPWO2022149395 A1 JP WO2022149395A1
- Authority
- JP
- Japan
- Legal status (The legal status is an assumption and is not a legal conclusion. Google has not performed a legal analysis and makes no representation as to the accuracy of the status listed.)
- Pending
Links
Classifications
-
- G—PHYSICS
- G16—INFORMATION AND COMMUNICATION TECHNOLOGY [ICT] SPECIALLY ADAPTED FOR SPECIFIC APPLICATION FIELDS
- G16C—COMPUTATIONAL CHEMISTRY; CHEMOINFORMATICS; COMPUTATIONAL MATERIALS SCIENCE
- G16C20/00—Chemoinformatics, i.e. ICT specially adapted for the handling of physicochemical or structural data of chemical particles, elements, compounds or mixtures
- G16C20/50—Molecular design, e.g. of drugs
-
- G—PHYSICS
- G16—INFORMATION AND COMMUNICATION TECHNOLOGY [ICT] SPECIALLY ADAPTED FOR SPECIFIC APPLICATION FIELDS
- G16C—COMPUTATIONAL CHEMISTRY; CHEMOINFORMATICS; COMPUTATIONAL MATERIALS SCIENCE
- G16C20/00—Chemoinformatics, i.e. ICT specially adapted for the handling of physicochemical or structural data of chemical particles, elements, compounds or mixtures
- G16C20/20—Identification of molecular entities, parts thereof or of chemical compositions
-
- G—PHYSICS
- G16—INFORMATION AND COMMUNICATION TECHNOLOGY [ICT] SPECIALLY ADAPTED FOR SPECIFIC APPLICATION FIELDS
- G16C—COMPUTATIONAL CHEMISTRY; CHEMOINFORMATICS; COMPUTATIONAL MATERIALS SCIENCE
- G16C20/00—Chemoinformatics, i.e. ICT specially adapted for the handling of physicochemical or structural data of chemical particles, elements, compounds or mixtures
- G16C20/80—Data visualisation
-
- G—PHYSICS
- G16—INFORMATION AND COMMUNICATION TECHNOLOGY [ICT] SPECIALLY ADAPTED FOR SPECIFIC APPLICATION FIELDS
- G16C—COMPUTATIONAL CHEMISTRY; CHEMOINFORMATICS; COMPUTATIONAL MATERIALS SCIENCE
- G16C20/00—Chemoinformatics, i.e. ICT specially adapted for the handling of physicochemical or structural data of chemical particles, elements, compounds or mixtures
- G16C20/90—Programming languages; Computing architectures; Database systems; Data warehousing
-
- G—PHYSICS
- G16—INFORMATION AND COMMUNICATION TECHNOLOGY [ICT] SPECIALLY ADAPTED FOR SPECIFIC APPLICATION FIELDS
- G16C—COMPUTATIONAL CHEMISTRY; CHEMOINFORMATICS; COMPUTATIONAL MATERIALS SCIENCE
- G16C20/00—Chemoinformatics, i.e. ICT specially adapted for the handling of physicochemical or structural data of chemical particles, elements, compounds or mixtures
- G16C20/30—Prediction of properties of chemical compounds, compositions or mixtures
Landscapes
- Engineering & Computer Science (AREA)
- Bioinformatics & Cheminformatics (AREA)
- Chemical & Material Sciences (AREA)
- Computing Systems (AREA)
- Theoretical Computer Science (AREA)
- Life Sciences & Earth Sciences (AREA)
- Crystallography & Structural Chemistry (AREA)
- Bioinformatics & Computational Biology (AREA)
- Physics & Mathematics (AREA)
- Spectroscopy & Molecular Physics (AREA)
- Health & Medical Sciences (AREA)
- Pharmacology & Pharmacy (AREA)
- Medicinal Chemistry (AREA)
- General Health & Medical Sciences (AREA)
- Data Mining & Analysis (AREA)
- Databases & Information Systems (AREA)
- Software Systems (AREA)
- Information Retrieval, Db Structures And Fs Structures Therefor (AREA)
- Organic Low-Molecular-Weight Compounds And Preparation Thereof (AREA)
Applications Claiming Priority (2)
| Application Number | Priority Date | Filing Date | Title |
|---|---|---|---|
| JP2021001611 | 2021-01-07 | ||
| PCT/JP2021/044993 WO2022149395A1 (ja) | 2021-01-07 | 2021-12-07 | 情報処理装置、情報処理方法、及び情報処理プログラム |
Publications (2)
| Publication Number | Publication Date |
|---|---|
| JPWO2022149395A1 true JPWO2022149395A1 (https=) | 2022-07-14 |
| JPWO2022149395A5 JPWO2022149395A5 (https=) | 2023-09-26 |
Family
ID=82357386
Family Applications (1)
| Application Number | Title | Priority Date | Filing Date |
|---|---|---|---|
| JP2022573954A Pending JPWO2022149395A1 (https=) | 2021-01-07 | 2021-12-07 |
Country Status (6)
| Country | Link |
|---|---|
| US (1) | US20230335230A1 (https=) |
| EP (1) | EP4276840A4 (https=) |
| JP (1) | JPWO2022149395A1 (https=) |
| CN (1) | CN116745759A (https=) |
| CA (1) | CA3203480A1 (https=) |
| WO (1) | WO2022149395A1 (https=) |
Families Citing this family (3)
| Publication number | Priority date | Publication date | Assignee | Title |
|---|---|---|---|---|
| JP7388578B1 (ja) | 2023-01-16 | 2023-11-29 | 住友ベークライト株式会社 | 化学構造提案方法、プログラム、および化学構造提案装置 |
| KR20240147234A (ko) * | 2023-03-31 | 2024-10-08 | 주식회사 엘지화학 | Lc-ms/ms의 조각 이온으로부터 모분자의 분자구조를 획득하는 방법 및 시스템 |
| JPWO2025009246A1 (https=) * | 2023-07-04 | 2025-01-09 |
Citations (7)
| Publication number | Priority date | Publication date | Assignee | Title |
|---|---|---|---|---|
| JP2006323833A (ja) * | 2005-04-19 | 2006-11-30 | Zoegene Corp | 生理活性化合物の設計方法及び設計装置、並びに生理活性化合物の設計プログラム |
| JP2007277188A (ja) * | 2006-04-10 | 2007-10-25 | Hitachi Ltd | 化合物検索支援システム |
| JP2013101510A (ja) * | 2011-11-08 | 2013-05-23 | Fujitsu Ltd | 情報提供装置、情報提供プログラムおよび情報提供方法 |
| US20190114390A1 (en) * | 2017-10-13 | 2019-04-18 | BioAge Labs, Inc. | Drug repurposing based on deep embeddings of gene expression profiles |
| US20190286791A1 (en) * | 2018-03-15 | 2019-09-19 | International Business Machines Corporation | Creation of new chemical compounds having desired properties using accumulated chemical data to construct a new chemical structure for synthesis |
| WO2020054841A1 (ja) * | 2018-09-14 | 2020-03-19 | 富士フイルム株式会社 | 化合物探索方法、化合物探索プログラム、記録媒体、及び化合物探索装置 |
| WO2020166486A1 (ja) * | 2019-02-12 | 2020-08-20 | Jsr株式会社 | データ処理方法、データ処理装置及びデータ処理システム |
Family Cites Families (4)
| Publication number | Priority date | Publication date | Assignee | Title |
|---|---|---|---|---|
| JP2001058962A (ja) | 1999-08-20 | 2001-03-06 | Mitsubishi Chemicals Corp | 分子構造開発支援システム及び分子構造開発支援方法、並びに、分子構造抽出装置，分子構造抽出方法及び分子構造抽出プログラムを格納したコンピュータ読取可能な記録媒体 |
| CN106650181B (zh) * | 2015-07-31 | 2021-08-06 | 中国石油化工股份有限公司 | 一种计算烃类化合物密度的方法 |
| WO2018230492A1 (ja) * | 2017-06-16 | 2018-12-20 | 本田技研工業株式会社 | 情報処理装置、情報処理方法、及びプログラム |
| JP2021001611A (ja) | 2019-06-19 | 2021-01-07 | 有限会社アールストーン | 配管支持具 |
-
2021
- 2021-12-07 JP JP2022573954A patent/JPWO2022149395A1/ja active Pending
- 2021-12-07 WO PCT/JP2021/044993 patent/WO2022149395A1/ja not_active Ceased
- 2021-12-07 EP EP21917616.1A patent/EP4276840A4/en active Pending
- 2021-12-07 CN CN202180089276.XA patent/CN116745759A/zh active Pending
- 2021-12-07 CA CA3203480A patent/CA3203480A1/en active Pending
-
2023
- 2023-06-23 US US18/340,039 patent/US20230335230A1/en active Pending
Patent Citations (7)
| Publication number | Priority date | Publication date | Assignee | Title |
|---|---|---|---|---|
| JP2006323833A (ja) * | 2005-04-19 | 2006-11-30 | Zoegene Corp | 生理活性化合物の設計方法及び設計装置、並びに生理活性化合物の設計プログラム |
| JP2007277188A (ja) * | 2006-04-10 | 2007-10-25 | Hitachi Ltd | 化合物検索支援システム |
| JP2013101510A (ja) * | 2011-11-08 | 2013-05-23 | Fujitsu Ltd | 情報提供装置、情報提供プログラムおよび情報提供方法 |
| US20190114390A1 (en) * | 2017-10-13 | 2019-04-18 | BioAge Labs, Inc. | Drug repurposing based on deep embeddings of gene expression profiles |
| US20190286791A1 (en) * | 2018-03-15 | 2019-09-19 | International Business Machines Corporation | Creation of new chemical compounds having desired properties using accumulated chemical data to construct a new chemical structure for synthesis |
| WO2020054841A1 (ja) * | 2018-09-14 | 2020-03-19 | 富士フイルム株式会社 | 化合物探索方法、化合物探索プログラム、記録媒体、及び化合物探索装置 |
| WO2020166486A1 (ja) * | 2019-02-12 | 2020-08-20 | Jsr株式会社 | データ処理方法、データ処理装置及びデータ処理システム |
Also Published As
| Publication number | Publication date |
|---|---|
| CN116745759A (zh) | 2023-09-12 |
| EP4276840A4 (en) | 2024-12-04 |
| WO2022149395A1 (ja) | 2022-07-14 |
| US20230335230A1 (en) | 2023-10-19 |
| EP4276840A1 (en) | 2023-11-15 |
| CA3203480A1 (en) | 2022-07-14 |
Similar Documents
Legal Events
| Date | Code | Title | Description |
|---|---|---|---|
| A521 | Request for written amendment filed |
Free format text: JAPANESE INTERMEDIATE CODE: A523 Effective date: 20230629 |
|
| A621 | Written request for application examination |
Free format text: JAPANESE INTERMEDIATE CODE: A621 Effective date: 20240909 |
|
| A131 | Notification of reasons for refusal |
Free format text: JAPANESE INTERMEDIATE CODE: A131 Effective date: 20251021 |
|
| A601 | Written request for extension of time |
Free format text: JAPANESE INTERMEDIATE CODE: A601 Effective date: 20251202 |