WebQuant is a module within Oniro platform designed to be used in typical workflows in the ADME and PK labs, where the result obtained is a quantification.
At the Module there are two sections that are differentiated by the need to include or not a Calibration Line in the experiment. For example, at a metabolic stability experiment, there is no need to prepare a calibration line to get the result: half-life and clearance.
But when the needed result is a Pharmacokinetic magnitude such as the bioavailability of a compound there is the need to quantitate the amount to product and calibration line should be included in the experiment.
The WebQuant follows the general principles of WebMetabase to define the units, variables, templates, protocols, and experiments.
It has some special behavior encoded in order to assure that any kind of experiment is performed following some minimum rules that apply to it: for example, in a Metabolic Stability experiment some timepoints should be used to calculate the Half Life, so the protocol should contain a variable for the incubation time, and that is forced at the Template level for the metabolic Stability experiment type.
Compound related information:
- Template, protocol, Experiment definition
- Workflow
- Clearance computation starting from an acquisition Sample list.
- Data process: Signal re-integration
Pharma – Data Analysis – HT DMPK Screening
Videos:
- PROTAC Metabolite Identification
- Practical Applications for Drug Discovery 2020 Webinar. Ismael Zamora
- Automation Of Metabolite Identification
- Practical Applications for Drug Discovery 2020 Webinar. Ismael Zamora
- Spatial Localization And Identification Of Drug And Metabolites
- Practical Applications for Drug Discovery 2020 Webinar. Sara Tortorella, Giulia Coliva
- DMPK Workflows: HT MS For Clearance Determination
- Practical Applications for Drug Discovery 2020 Webinar. Ismael Zamora
Biopharma – Data Analysis – HT DMPK Screening
Videos:
- DMPK Workflows: HT MS For Clearance Determination
- Practical Applications for Drug Discovery 2020 Webinar. Ismael Zamora
Environmental – Soil And Water Analysis
Articles:
- Degradation studies of dimethachlor in soils and water by UHPLC-HRMS: putative elucidation of unknown metabolites
- February 2020. López-Ruiz R; Romero-González R; Ortega-Carrasco E; Martínez Vidal JL; Garrido Frenich A
Posters:
- Automatic MS Data Analysis to reveal the metabolic pathways of pesticides in fruits and soils
- 256th ACS National Meeting, Boston, MA (United States of America) 21 August, 2018
Environmental – Dissipation Analysis For Multiple Pesticides
Articles:
- Dissipation studies of famoxadone in vegetables under greenhouse conditions using liquid chromatography coupled to high-resolution mass spectrometry: putative elucidation of a new metabolite
- September 2019. López-Ruiz R; Romero-González R; Ortega-Carrasco E; Garrido Frenich A
- Dissipation kinetic studies of fenamidone and propamocarb in vegetables under greenhouse conditions using liquid and gas chromatography coupled to high-resolution mass spectrometry
- July 2019. López-Ruiz R; Romero-González R; Serra B; Garrido Frenich A
