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WO2002010746A3 - Pharmacokinetic tool and method for predicting metabolism of a compound in a mammal - Google Patents

Pharmacokinetic tool and method for predicting metabolism of a compound in a mammal Download PDF

Info

Publication number
WO2002010746A3
WO2002010746A3 PCT/US2001/023867 US0123867W WO0210746A3 WO 2002010746 A3 WO2002010746 A3 WO 2002010746A3 US 0123867 W US0123867 W US 0123867W WO 0210746 A3 WO0210746 A3 WO 0210746A3
Authority
WO
WIPO (PCT)
Prior art keywords
compound
metabolism
rate
mammal
liver
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.)
Ceased
Application number
PCT/US2001/023867
Other languages
French (fr)
Other versions
WO2002010746A2 (en
Inventor
Glen D Leesman
Daniel A Norris
Patrick J Sinko
Kevin Holme
Tatyana Izhikevich
Julie Doerr-Stevens
Edward Lecluyse
Dhiren R Thakker
George M Grass
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.)
Sygnis Pharma AG
Original Assignee
Lion Bioscience AG
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 Lion Bioscience AG filed Critical Lion Bioscience AG
Priority to EP01956037A priority Critical patent/EP1386274A2/en
Priority to CA002416810A priority patent/CA2416810A1/en
Priority to AU2001278075A priority patent/AU2001278075A1/en
Priority to JP2002516622A priority patent/JP2004514879A/en
Priority to US10/332,996 priority patent/US20040039530A1/en
Publication of WO2002010746A2 publication Critical patent/WO2002010746A2/en
Anticipated expiration legal-status Critical
Publication of WO2002010746A3 publication Critical patent/WO2002010746A3/en
Ceased legal-status Critical Current

Links

Classifications

    • G—PHYSICS
    • G16—INFORMATION AND COMMUNICATION TECHNOLOGY [ICT] SPECIALLY ADAPTED FOR SPECIFIC APPLICATION FIELDS
    • G16H—HEALTHCARE INFORMATICS, i.e. INFORMATION AND COMMUNICATION TECHNOLOGY [ICT] SPECIALLY ADAPTED FOR THE HANDLING OR PROCESSING OF MEDICAL OR HEALTHCARE DATA
    • G16H10/00—ICT specially adapted for the handling or processing of patient-related medical or healthcare data
    • G16H10/40—ICT specially adapted for the handling or processing of patient-related medical or healthcare data for data related to laboratory analysis, e.g. patient specimen analysis
    • 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
    • G—PHYSICS
    • G16—INFORMATION AND COMMUNICATION TECHNOLOGY [ICT] SPECIALLY ADAPTED FOR SPECIFIC APPLICATION FIELDS
    • G16H—HEALTHCARE INFORMATICS, i.e. INFORMATION AND COMMUNICATION TECHNOLOGY [ICT] SPECIALLY ADAPTED FOR THE HANDLING OR PROCESSING OF MEDICAL OR HEALTHCARE DATA
    • G16H50/00—ICT specially adapted for medical diagnosis, medical simulation or medical data mining; ICT specially adapted for detecting, monitoring or modelling epidemics or pandemics
    • G16H50/50—ICT specially adapted for medical diagnosis, medical simulation or medical data mining; ICT specially adapted for detecting, monitoring or modelling epidemics or pandemics for simulation or modelling of medical disorders

Landscapes

  • Engineering & Computer Science (AREA)
  • Medical Informatics (AREA)
  • Health & Medical Sciences (AREA)
  • Public Health (AREA)
  • Primary Health Care (AREA)
  • Epidemiology (AREA)
  • General Health & Medical Sciences (AREA)
  • Chemical & Material Sciences (AREA)
  • Data Mining & Analysis (AREA)
  • Pathology (AREA)
  • Biomedical Technology (AREA)
  • Databases & Information Systems (AREA)
  • Crystallography & Structural Chemistry (AREA)
  • Life Sciences & Earth Sciences (AREA)
  • Bioinformatics & Cheminformatics (AREA)
  • Bioinformatics & Computational Biology (AREA)
  • Computing Systems (AREA)
  • Theoretical Computer Science (AREA)
  • Investigating Or Analysing Biological Materials (AREA)
  • Measuring Or Testing Involving Enzymes Or Micro-Organisms (AREA)

Abstract

A system for simulating metabolism of a compound in a mammal is disclosed that includes a metabolism simulation model of a mammalian liver. This model has equations which when executed on a computer, calculate the rate of metabolism of the compound in the cells of the mammalian liver and a rate of transport of the compound into the cells, wherein the simulation model determines an amount of the metabolism product. The rate of metabolism may be a rate of depletion of the compound. The metabolism product may be an amount of the compound remaining after the compound's first passage through the mammalian liver (This is not necessarily limited to first pass, nor would it need to be limited to the liver. Intestinal metabolism could also be modeled). The rate of metabolism may alternatively be a rate of accumulation of a metabolite of the compound.
PCT/US2001/023867 2000-07-28 2001-07-30 Pharmacokinetic tool and method for predicting metabolism of a compound in a mammal Ceased WO2002010746A2 (en)

Priority Applications (5)

Application Number Priority Date Filing Date Title
EP01956037A EP1386274A2 (en) 2000-07-28 2001-07-30 Pharmacokinetic tool and method for predicting metabolism of a compound in a mammal
CA002416810A CA2416810A1 (en) 2000-07-28 2001-07-30 Pharmacokinetic tool and method for predicting metabolism of a compound in a mammal
AU2001278075A AU2001278075A1 (en) 2000-07-28 2001-07-30 Pharmacokinetic tool and method for predicting metabolism of a compound in a mammal
JP2002516622A JP2004514879A (en) 2000-07-28 2001-07-30 Pharmacokinetic tools and methods for predicting metabolism of compounds in mammals
US10/332,996 US20040039530A1 (en) 2001-07-30 2001-07-30 Pharmacokinetic tool and method for predicting metabolism of a compound in a mammal

Applications Claiming Priority (8)

Application Number Priority Date Filing Date Title
US22154800P 2000-07-28 2000-07-28
US60/221,548 2000-07-28
US24410600P 2000-10-27 2000-10-27
US60/244,106 2000-10-27
US26743601P 2001-02-09 2001-02-09
US60/267,436 2001-02-09
US28879301P 2001-05-07 2001-05-07
US60/288,793 2001-05-07

Publications (2)

Publication Number Publication Date
WO2002010746A2 WO2002010746A2 (en) 2002-02-07
WO2002010746A3 true WO2002010746A3 (en) 2003-11-06

Family

ID=27499234

Family Applications (1)

Application Number Title Priority Date Filing Date
PCT/US2001/023867 Ceased WO2002010746A2 (en) 2000-07-28 2001-07-30 Pharmacokinetic tool and method for predicting metabolism of a compound in a mammal

Country Status (5)

Country Link
EP (1) EP1386274A2 (en)
JP (1) JP2004514879A (en)
AU (1) AU2001278075A1 (en)
CA (1) CA2416810A1 (en)
WO (1) WO2002010746A2 (en)

Families Citing this family (6)

* Cited by examiner, † Cited by third party
Publication number Priority date Publication date Assignee Title
KR20050012281A (en) 2002-06-14 2005-01-31 화이자 인코포레이티드 Metabolic phenotyping
JP4947368B2 (en) * 2007-07-23 2012-06-06 ソニー株式会社 Information processing apparatus and method, and program
CN102621282A (en) * 2012-03-07 2012-08-01 泰州瑞赛康医药科技有限公司 Virtual liver model for innovative medicine research
WO2014089478A1 (en) * 2012-12-07 2014-06-12 University Of Tennessee Research Foundation Methods of numerical analysis for platelet disorders and computer-readable media and systems for performing the same
JP6559850B1 (en) 2018-07-27 2019-08-14 Ｋａｒｙｄｏ ＴｈｅｒａｐｅｕｔｉＸ株式会社 Artificial intelligence model for predicting the effects of test substances in humans
CN115315754A (en) * 2020-01-17 2022-11-08 无限生物制药公司 Prediction method, prediction device, and prediction program for indication focusing on drug or drug equivalent

Citations (2)

* Cited by examiner, † Cited by third party
Publication number Priority date Publication date Assignee Title
WO1998009166A1 (en) * 1996-08-29 1998-03-05 Chiron Corporation Method for analysing absorption, distribution, metabolism, excretion (adme) and pharmacokinetics properties of compound mixtures
WO2000016231A1 (en) * 1998-09-14 2000-03-23 Navicyte, Inc. Method for screening and producing compound libraries

Patent Citations (2)

* Cited by examiner, † Cited by third party
Publication number Priority date Publication date Assignee Title
WO1998009166A1 (en) * 1996-08-29 1998-03-05 Chiron Corporation Method for analysing absorption, distribution, metabolism, excretion (adme) and pharmacokinetics properties of compound mixtures
WO2000016231A1 (en) * 1998-09-14 2000-03-23 Navicyte, Inc. Method for screening and producing compound libraries

Non-Patent Citations (1)

* Cited by examiner, † Cited by third party
Title
POPOVIC J: "RELATIONSHIP BETWEEN THE STEADY-STATE SERUM LEVEL AND THE DOSE OF DRUGS WITH FIRST-PASS AND PARALLEL MICHAELIS-MENTEN AND FIRST-ORDER ELIMINATION", ACTA PHARMACEUTICA JUGOSLAVICA, vol. 37, no. 4, 1987, pages 313 - 318, XP008021179 *

Also Published As

Publication number Publication date
JP2004514879A (en) 2004-05-20
CA2416810A1 (en) 2002-02-07
AU2001278075A1 (en) 2002-02-13
EP1386274A2 (en) 2004-02-04
WO2002010746A2 (en) 2002-02-07

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