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AU2001215557A1 - Method of designing the molecular structure of inhibitor to enzyme - Google Patents

Method of designing the molecular structure of inhibitor to enzyme

Info

Publication number
AU2001215557A1
AU2001215557A1 AU2001215557A AU1555701A AU2001215557A1 AU 2001215557 A1 AU2001215557 A1 AU 2001215557A1 AU 2001215557 A AU2001215557 A AU 2001215557A AU 1555701 A AU1555701 A AU 1555701A AU 2001215557 A1 AU2001215557 A1 AU 2001215557A1
Authority
AU
Australia
Prior art keywords
designing
inhibitor
enzyme
molecular structure
molecular
Prior art date
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.)
Abandoned
Application number
AU2001215557A
Inventor
Yoshiyuki Mizushina
Kengo Sakaguchi
Fumio Sugawara
Current Assignee (The listed assignees may be inaccurate. Google has not performed a legal analysis and makes no representation or warranty as to the accuracy of the list.)
Toyo Suisan Kaisha Ltd
Original Assignee
Toyo Suisan Kaisha Ltd
Priority date (The priority date 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 date listed.)
Filing date
Publication date
Application filed by Toyo Suisan Kaisha Ltd filed Critical Toyo Suisan Kaisha Ltd
Publication of AU2001215557A1 publication Critical patent/AU2001215557A1/en
Abandoned legal-status Critical Current

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
    • C—CHEMISTRY; METALLURGY
    • C07—ORGANIC CHEMISTRY
    • C07B—GENERAL METHODS OF ORGANIC CHEMISTRY; APPARATUS THEREFOR
    • C07B61/00—Other general methods
    • 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
    • G16B20/00—ICT specially adapted for functional genomics or proteomics, e.g. genotype-phenotype associations
    • G16B20/30—Detection of binding sites or motifs
    • 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
    • G16B20/00—ICT specially adapted for functional genomics or proteomics, e.g. genotype-phenotype associations

Landscapes

  • Chemical & Material Sciences (AREA)
  • Physics & Mathematics (AREA)
  • Life Sciences & Earth Sciences (AREA)
  • Health & Medical Sciences (AREA)
  • Engineering & Computer Science (AREA)
  • Bioinformatics & Cheminformatics (AREA)
  • Spectroscopy & Molecular Physics (AREA)
  • Biotechnology (AREA)
  • Medical Informatics (AREA)
  • Theoretical Computer Science (AREA)
  • Bioinformatics & Computational Biology (AREA)
  • Biophysics (AREA)
  • Evolutionary Biology (AREA)
  • General Health & Medical Sciences (AREA)
  • Organic Chemistry (AREA)
  • Crystallography & Structural Chemistry (AREA)
  • Analytical Chemistry (AREA)
  • Proteomics, Peptides & Aminoacids (AREA)
  • Genetics & Genomics (AREA)
  • Molecular Biology (AREA)
  • Medicinal Chemistry (AREA)
  • Pharmacology & Pharmacy (AREA)
  • Measuring Or Testing Involving Enzymes Or Micro-Organisms (AREA)
  • Investigating Or Analysing Biological Materials (AREA)
  • Enzymes And Modification Thereof (AREA)
AU2001215557A 2000-11-30 2000-11-30 Method of designing the molecular structure of inhibitor to enzyme Abandoned AU2001215557A1 (en)

Applications Claiming Priority (1)

Application Number Priority Date Filing Date Title
PCT/JP2000/008467 WO2002044112A1 (en) 2000-11-30 2000-11-30 Method of designing the molecular structure of inhibitor to enzyme

Publications (1)

Publication Number Publication Date
AU2001215557A1 true AU2001215557A1 (en) 2002-06-11

Family

ID=11736741

Family Applications (1)

Application Number Title Priority Date Filing Date
AU2001215557A Abandoned AU2001215557A1 (en) 2000-11-30 2000-11-30 Method of designing the molecular structure of inhibitor to enzyme

Country Status (5)

Country Link
US (1) US20040093169A1 (en)
EP (1) EP1344761A4 (en)
JP (1) JPWO2002044112A1 (en)
AU (1) AU2001215557A1 (en)
WO (1) WO2002044112A1 (en)

Families Citing this family (1)

* Cited by examiner, † Cited by third party
Publication number Priority date Publication date Assignee Title
WO2008154432A2 (en) * 2007-06-06 2008-12-18 The Regents Of The University Of California Crystalline topoisomerase/dna complexes

Family Cites Families (9)

* Cited by examiner, † Cited by third party
Publication number Priority date Publication date Assignee Title
US5260882A (en) * 1991-01-02 1993-11-09 Rohm And Haas Company Process for the estimation of physical and chemical properties of a proposed polymeric or copolymeric substance or material
ATE199109T1 (en) * 1992-03-27 2001-02-15 Akiko Itai METHOD FOR ANALYZING THE STRUCTURE OF STABLE COMPOSITE BIOPOLYMER LIGAND MOLECULES
US5434796A (en) * 1993-06-30 1995-07-18 Daylight Chemical Information Systems, Inc. Method and apparatus for designing molecules with desired properties by evolving successive populations
JP3785195B2 (en) * 1993-11-11 2006-06-14 昭子 板井 Method for constructing the molecular structure of a biologically active ligand
CN1150478C (en) * 1994-10-31 2004-05-19 板井昭子 A Method for Retrieving New Coordination Compounds from 3D Structure Database
WO1997018180A1 (en) * 1995-11-13 1997-05-22 Akiko Itai Design method of physiologically active compound
EP1010681A4 (en) * 1995-12-28 2002-06-12 Akiko Itai METHOD FOR PRODUCING A PHYSIOLOGICALLY EFFECTIVE CONNECTION
EP0888591A1 (en) * 1996-03-22 1999-01-07 University Of Guelph Computational method for designing chemical structures having common functional characteristics
CA2294771A1 (en) * 1997-07-03 1999-01-14 Akiko Itai Method for inferring protein functions with the use of ligand data base

Also Published As

Publication number Publication date
US20040093169A1 (en) 2004-05-13
EP1344761A1 (en) 2003-09-17
JPWO2002044112A1 (en) 2004-04-02
EP1344761A4 (en) 2008-04-16
WO2002044112A1 (en) 2002-06-06

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