SG11201408017VA - Interaction prediction device, interaction prediction method, and computer program product - Google Patents
Interaction prediction device, interaction prediction method, and computer program productInfo
- Publication number
- SG11201408017VA SG11201408017VA SG11201408017VA SG11201408017VA SG11201408017VA SG 11201408017V A SG11201408017V A SG 11201408017VA SG 11201408017V A SG11201408017V A SG 11201408017VA SG 11201408017V A SG11201408017V A SG 11201408017VA SG 11201408017V A SG11201408017V A SG 11201408017VA
- Authority
- SG
- Singapore
- Prior art keywords
- predicted
- lllll
- interaction
- strength
- bonding strength
- Prior art date
Links
Classifications
-
- G—PHYSICS
- G16—INFORMATION AND COMMUNICATION TECHNOLOGY [ICT] SPECIALLY ADAPTED FOR SPECIFIC APPLICATION FIELDS
- G16B—BIOINFORMATICS, i.e. INFORMATION AND COMMUNICATION TECHNOLOGY [ICT] SPECIALLY ADAPTED FOR GENETIC OR PROTEIN-RELATED DATA PROCESSING IN COMPUTATIONAL MOLECULAR BIOLOGY
- G16B15/00—ICT specially adapted for analysing two-dimensional or three-dimensional molecular structures, e.g. structural or functional relations or structure alignment
- G16B15/30—Drug targeting using structural data; Docking or binding prediction
-
- G—PHYSICS
- G01—MEASURING; TESTING
- G01N—INVESTIGATING OR ANALYSING MATERIALS BY DETERMINING THEIR CHEMICAL OR PHYSICAL PROPERTIES
- G01N33/00—Investigating or analysing materials by specific methods not covered by groups G01N1/00 - G01N31/00
- G01N33/48—Biological material, e.g. blood, urine; Haemocytometers
- G01N33/50—Chemical analysis of biological material, e.g. blood, urine; Testing involving biospecific ligand binding methods; Immunological testing
- G01N33/68—Chemical analysis of biological material, e.g. blood, urine; Testing involving biospecific ligand binding methods; Immunological testing involving proteins, peptides or amino acids
-
- G—PHYSICS
- G16—INFORMATION AND COMMUNICATION TECHNOLOGY [ICT] SPECIALLY ADAPTED FOR SPECIFIC APPLICATION FIELDS
- G16B—BIOINFORMATICS, i.e. INFORMATION AND COMMUNICATION TECHNOLOGY [ICT] SPECIALLY ADAPTED FOR GENETIC OR PROTEIN-RELATED DATA PROCESSING IN COMPUTATIONAL MOLECULAR BIOLOGY
- G16B15/00—ICT specially adapted for analysing two-dimensional or three-dimensional molecular structures, e.g. structural or functional relations or structure alignment
-
- G—PHYSICS
- G16—INFORMATION AND COMMUNICATION TECHNOLOGY [ICT] SPECIALLY ADAPTED FOR SPECIFIC APPLICATION FIELDS
- G16B—BIOINFORMATICS, i.e. INFORMATION AND COMMUNICATION TECHNOLOGY [ICT] SPECIALLY ADAPTED FOR GENETIC OR PROTEIN-RELATED DATA PROCESSING IN COMPUTATIONAL MOLECULAR BIOLOGY
- G16B35/00—ICT specially adapted for in silico combinatorial libraries of nucleic acids, proteins or peptides
-
- 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
- G16C20/60—In silico combinatorial chemistry
Landscapes
- Life Sciences & Earth Sciences (AREA)
- Health & Medical Sciences (AREA)
- Engineering & Computer Science (AREA)
- Chemical & Material Sciences (AREA)
- Physics & Mathematics (AREA)
- Spectroscopy & Molecular Physics (AREA)
- Bioinformatics & Cheminformatics (AREA)
- General Health & Medical Sciences (AREA)
- Bioinformatics & Computational Biology (AREA)
- Theoretical Computer Science (AREA)
- Biotechnology (AREA)
- Crystallography & Structural Chemistry (AREA)
- Biophysics (AREA)
- Medical Informatics (AREA)
- Evolutionary Biology (AREA)
- Medicinal Chemistry (AREA)
- Molecular Biology (AREA)
- Biochemistry (AREA)
- Computing Systems (AREA)
- Pharmacology & Pharmacy (AREA)
- Library & Information Science (AREA)
- Immunology (AREA)
- Urology & Nephrology (AREA)
- Biomedical Technology (AREA)
- Hematology (AREA)
- Cell Biology (AREA)
- Microbiology (AREA)
- Proteomics, Peptides & Aminoacids (AREA)
- Food Science & Technology (AREA)
- Analytical Chemistry (AREA)
- General Physics & Mathematics (AREA)
- Pathology (AREA)
- Information Retrieval, Db Structures And Fs Structures Therefor (AREA)
- Management, Administration, Business Operations System, And Electronic Commerce (AREA)
- Peptides Or Proteins (AREA)
- Investigating Or Analysing Biological Materials (AREA)
- Apparatus Associated With Microorganisms And Enzymes (AREA)
- Complex Calculations (AREA)
Applications Claiming Priority (2)
| Application Number | Priority Date | Filing Date | Title |
|---|---|---|---|
| JP2012134261A JP5905781B2 (ja) | 2012-06-13 | 2012-06-13 | 相互作用予測装置、相互作用予測方法、および、プログラム |
| PCT/JP2013/066323 WO2013187468A1 (ja) | 2012-06-13 | 2013-06-13 | 相互作用予測装置、相互作用予測方法、および、プログラム |
Publications (1)
| Publication Number | Publication Date |
|---|---|
| SG11201408017VA true SG11201408017VA (en) | 2015-01-29 |
Family
ID=49758286
Family Applications (1)
| Application Number | Title | Priority Date | Filing Date |
|---|---|---|---|
| SG11201408017VA SG11201408017VA (en) | 2012-06-13 | 2013-06-13 | Interaction prediction device, interaction prediction method, and computer program product |
Country Status (10)
| Country | Link |
|---|---|
| US (1) | US20150169822A1 (de) |
| EP (1) | EP2862924A4 (de) |
| JP (1) | JP5905781B2 (de) |
| KR (1) | KR101606160B1 (de) |
| CN (1) | CN104350141B (de) |
| AU (1) | AU2013275211B2 (de) |
| CA (1) | CA2876051A1 (de) |
| RU (1) | RU2607039C2 (de) |
| SG (1) | SG11201408017VA (de) |
| WO (1) | WO2013187468A1 (de) |
Families Citing this family (10)
| Publication number | Priority date | Publication date | Assignee | Title |
|---|---|---|---|---|
| WO2017062382A1 (en) * | 2015-10-04 | 2017-04-13 | Atomwise Inc. | Systems and methods for applying a convolutional network to spatial data |
| KR102457974B1 (ko) | 2015-11-04 | 2022-10-21 | 삼성전자주식회사 | 신규 물질 탐색 방법 및 장치 |
| JP2019508821A (ja) * | 2015-12-31 | 2019-03-28 | サイクリカ インクＣｙｃｌｉｃａ Ｉｎｃ． | タンパク質−リガンド相互作用を同定するためのプロテオームドッキング方法 |
| KR101809599B1 (ko) * | 2016-02-04 | 2017-12-15 | 연세대학교 산학협력단 | 약물과 단백질 간 관계 분석 방법 및 장치 |
| WO2018097635A1 (ko) * | 2016-11-24 | 2018-05-31 | 한양대학교 산학협력단 | 비구조-구조 전이 부위를 표적으로 하는 신약 후보 물질 발굴 방법 및 신약 후보 물질 발굴 장치 |
| KR102220653B1 (ko) * | 2017-10-30 | 2021-03-02 | 서울대학교산학협력단 | 심화 학습 기반의 약물-표적 단백질 간 상호작용 예측 시스템 및 그 방법 |
| GB2573102A (en) * | 2018-04-20 | 2019-10-30 | Drugai Ltd | Interaction property prediction system and method |
| US20210183475A1 (en) * | 2019-12-16 | 2021-06-17 | John McDevitt | System and method for improved genetic modifications to support beneficial adaptation to unanticipated conditions and unintended consequences by utilizing randomization |
| CN111816252B (zh) * | 2020-07-21 | 2021-08-31 | 腾讯科技（深圳）有限公司 | 一种药物筛选方法、装置及电子设备 |
| CN115862768B (zh) * | 2022-12-11 | 2023-09-01 | 南昌大学 | 一种用于大规模药物虚拟筛选的优化方法 |
Family Cites Families (7)
| Publication number | Priority date | Publication date | Assignee | Title |
|---|---|---|---|---|
| JP3443039B2 (ja) * | 1999-06-21 | 2003-09-02 | 科学技術振興事業団 | ネットワーク推定方法および装置 |
| JP2001188768A (ja) * | 1999-12-28 | 2001-07-10 | Japan Science & Technology Corp | ネットワーク推定方法 |
| FR2888850B1 (fr) * | 2005-07-22 | 2013-01-11 | Pf Medicament | Nouveaux anticorps anti-igf-ir et leurs applications |
| JP2007219760A (ja) * | 2006-02-15 | 2007-08-30 | Fujitsu Ltd | ドッキングシミュレーションプログラム、該プログラムを記録した記録媒体、ドッキングシミュレーション装置、およびドッキングシミュレーション方法 |
| JP5093110B2 (ja) * | 2006-09-21 | 2012-12-05 | アステラス製薬株式会社 | リガンドの探索方法 |
| JP5447383B2 (ja) * | 2008-09-05 | 2014-03-19 | 国立大学法人神戸大学 | 酵素活性をコンピュータを用いたシミュレーションにより予測する方法 |
| JP5336453B2 (ja) * | 2010-10-01 | 2013-11-06 | 学校法人沖縄科学技術大学院大学学園 | ネットワークモデル統合装置、ネットワークモデル統合システム、ネットワークモデル統合方法、および、プログラム |
-
2012
- 2012-06-13 JP JP2012134261A patent/JP5905781B2/ja active Active
-
2013
- 2013-06-13 WO PCT/JP2013/066323 patent/WO2013187468A1/ja active Application Filing
- 2013-06-13 EP EP13803610.8A patent/EP2862924A4/de not_active Ceased
- 2013-06-13 KR KR1020147034564A patent/KR101606160B1/ko active IP Right Grant
- 2013-06-13 RU RU2014153560A patent/RU2607039C2/ru not_active IP Right Cessation
- 2013-06-13 SG SG11201408017VA patent/SG11201408017VA/en unknown
- 2013-06-13 CA CA2876051A patent/CA2876051A1/en not_active Abandoned
- 2013-06-13 US US14/407,835 patent/US20150169822A1/en not_active Abandoned
- 2013-06-13 AU AU2013275211A patent/AU2013275211B2/en not_active Ceased
- 2013-06-13 CN CN201380030089.XA patent/CN104350141B/zh active Active
Also Published As
| Publication number | Publication date |
|---|---|
| JP2013255467A (ja) | 2013-12-26 |
| WO2013187468A1 (ja) | 2013-12-19 |
| AU2013275211A1 (en) | 2015-01-15 |
| US20150169822A1 (en) | 2015-06-18 |
| EP2862924A1 (de) | 2015-04-22 |
| KR20150008179A (ko) | 2015-01-21 |
| EP2862924A4 (de) | 2015-12-23 |
| KR101606160B1 (ko) | 2016-03-24 |
| RU2014153560A (ru) | 2016-08-10 |
| JP5905781B2 (ja) | 2016-04-20 |
| CN104350141B (zh) | 2016-04-27 |
| CA2876051A1 (en) | 2013-12-19 |
| CN104350141A (zh) | 2015-02-11 |
| RU2607039C2 (ru) | 2017-01-10 |
| AU2013275211B2 (en) | 2016-05-12 |
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