FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2896463595> ?p ?o ?g. }

• W2896463595 endingPage "646" @default.
• W2896463595 startingPage "634" @default.
• W2896463595 abstract "New generation of toxicological tests and assessment strategies require validated toxicokinetic data or models that are lacking for most chemicals. This study aimed at developing a quantitative property-property relationship (QPPR)-based human physiologically based pharmacokinetic (PBPK) modeling framework for high-throughput predictions of inhalation toxicokinetics of organic chemicals. A PBPK model was parameterized with QPPR-derived values for hepatic clearance (CLh) and partition coefficients (P) [blood:air (Pba) and tissue:air (Pta) and tissue:blood (Ptb)]. The model was initially applied to an evaluation dataset of 40 organic chemicals in the applicability domain, and then to an expanded dataset of 249 organic chemicals from diverse chemical classes. 'Batch' analyses were performed for rapid assessments of hundreds of chemicals. The simulations of inhalation toxicokinetics following an 8-h exposure to 1 ppm of each chemical were successful. The mean ratios of their predicted-to-experimental values were within a factor of 1.36-2.36 for Ptb and 1.18 for CLh, for 80% of the chemicals in the evaluation dataset. The predicted 24-h area under the venous blood concentration-time curve (AUC24) values were within the predicted envelopes obtained while using experimental values of Pba and considering either no or maximal hepatic extraction. The reliability analysis (based on combined sensitivity and uncertainty analyses) indicated that AUC24 predictions for 55% of the expanded dataset were moderately to highly reliable, with 46% exhibiting highly reliable values. Overall, the modeling framework suggests that molecular structure and chemical properties can together be effectively used to obtain first-cut estimates of the toxicokinetics of data-poor organic chemicals for screening and prioritization purposes." @default.
• W2896463595 created "2018-10-26" @default.
• W2896463595 creator A5016163777 @default.
• W2896463595 creator A5064615033 @default.
• W2896463595 date "2019-01-01" @default.
• W2896463595 modified "2023-10-01" @default.
• W2896463595 title "A framework for application of quantitative property-property relationships (QPPRs) in physiologically based pharmacokinetic (PBPK) models for high-throughput prediction of internal dose of inhaled organic chemicals" @default.
• W2896463595 cites W1574554412 @default.
• W2896463595 cites W1774595266 @default.
• W2896463595 cites W1879339955 @default.
• W2896463595 cites W1975377405 @default.
• W2896463595 cites W1979152210 @default.
• W2896463595 cites W1979264461 @default.
• W2896463595 cites W1979610882 @default.
• W2896463595 cites W1983282636 @default.
• W2896463595 cites W1989365618 @default.
• W2896463595 cites W1990762022 @default.
• W2896463595 cites W2010152279 @default.
• W2896463595 cites W2012496576 @default.
• W2896463595 cites W2012929832 @default.
• W2896463595 cites W2026015795 @default.
• W2896463595 cites W2029333481 @default.
• W2896463595 cites W2041777107 @default.
• W2896463595 cites W2055526313 @default.
• W2896463595 cites W2064093900 @default.
• W2896463595 cites W2069457036 @default.
• W2896463595 cites W2075288278 @default.
• W2896463595 cites W2084542755 @default.
• W2896463595 cites W2086943203 @default.
• W2896463595 cites W2092269495 @default.
• W2896463595 cites W2096127677 @default.
• W2896463595 cites W2110403403 @default.
• W2896463595 cites W2113116302 @default.
• W2896463595 cites W2124425953 @default.
• W2896463595 cites W2127676159 @default.
• W2896463595 cites W2132759637 @default.
• W2896463595 cites W2141684093 @default.
• W2896463595 cites W2142538954 @default.
• W2896463595 cites W2147334256 @default.
• W2896463595 cites W2149650021 @default.
• W2896463595 cites W2171292751 @default.
• W2896463595 cites W2266055629 @default.
• W2896463595 cites W2615026730 @default.
• W2896463595 cites W2740743653 @default.
• W2896463595 cites W2758866647 @default.
• W2896463595 cites W2791653123 @default.
• W2896463595 cites W2963710728 @default.
• W2896463595 cites W4230626870 @default.
• W2896463595 doi "https://doi.org/10.1016/j.chemosphere.2018.10.041" @default.
• W2896463595 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/30347358" @default.
• W2896463595 hasPublicationYear "2019" @default.
• W2896463595 type Work @default.
• W2896463595 sameAs 2896463595 @default.
• W2896463595 citedByCount "5" @default.
• W2896463595 countsByYear W28964635952019 @default.
• W2896463595 countsByYear W28964635952020 @default.
• W2896463595 countsByYear W28964635952022 @default.
• W2896463595 crossrefType "journal-article" @default.
• W2896463595 hasAuthorship W2896463595A5016163777 @default.
• W2896463595 hasAuthorship W2896463595A5064615033 @default.
• W2896463595 hasConcept C107872376 @default.
• W2896463595 hasConcept C112705442 @default.
• W2896463595 hasConcept C178790620 @default.
• W2896463595 hasConcept C185592680 @default.
• W2896463595 hasConcept C185867374 @default.
• W2896463595 hasConcept C186060115 @default.
• W2896463595 hasConcept C192552737 @default.
• W2896463595 hasConcept C195289149 @default.
• W2896463595 hasConcept C2779777708 @default.
• W2896463595 hasConcept C29730261 @default.
• W2896463595 hasConcept C2985358483 @default.
• W2896463595 hasConcept C43617362 @default.
• W2896463595 hasConcept C71924100 @default.
• W2896463595 hasConcept C86803240 @default.
• W2896463595 hasConcept C98274493 @default.
• W2896463595 hasConceptScore W2896463595C107872376 @default.
• W2896463595 hasConceptScore W2896463595C112705442 @default.
• W2896463595 hasConceptScore W2896463595C178790620 @default.
• W2896463595 hasConceptScore W2896463595C185592680 @default.
• W2896463595 hasConceptScore W2896463595C185867374 @default.
• W2896463595 hasConceptScore W2896463595C186060115 @default.
• W2896463595 hasConceptScore W2896463595C192552737 @default.
• W2896463595 hasConceptScore W2896463595C195289149 @default.
• W2896463595 hasConceptScore W2896463595C2779777708 @default.
• W2896463595 hasConceptScore W2896463595C29730261 @default.
• W2896463595 hasConceptScore W2896463595C2985358483 @default.
• W2896463595 hasConceptScore W2896463595C43617362 @default.
• W2896463595 hasConceptScore W2896463595C71924100 @default.
• W2896463595 hasConceptScore W2896463595C86803240 @default.
• W2896463595 hasConceptScore W2896463595C98274493 @default.
• W2896463595 hasFunder F4320335063 @default.
• W2896463595 hasLocation W28964635951 @default.
• W2896463595 hasLocation W28964635952 @default.
• W2896463595 hasOpenAccess W2896463595 @default.
• W2896463595 hasPrimaryLocation W28964635951 @default.
• W2896463595 hasRelatedWork W1985630146 @default.
• W2896463595 hasRelatedWork W2034456302 @default.
• W2896463595 hasRelatedWork W2039482963 @default.

• next