LVPocket: integrated 3D global-local information to protein binding pockets prediction with transfer learning of protein structure classification.

Autor: Zhou, Ruifeng¹ (AUTHOR), Fan, Jing¹ (AUTHOR), Li, Sishu¹ (AUTHOR), Zeng, Wenjie¹ (AUTHOR), Chen, Yilun¹ (AUTHOR), Zheng, Xiaoshan¹ (AUTHOR), Chen, Hongyang² (AUTHOR) hongyang@zhejianglab.com, Liao, Jun^1,3 (AUTHOR) liaojun@cpu.edu.cn

Publikováno v: Journal of Cheminformatics. 7/7/2024, Vol. 16 Issue 1, p1-12. 12p.

Interference of Plasticizers on Plasma Protein Binding Measurements.

Autor: Harrison M; Pfizer Worldwide Research and Development, Groton, CT, USA.; AstraZeneca, New Haven, CT, USA., Jordan S; Pfizer Worldwide Research and Development, Groton, CT, USA., Di L; Pfizer Worldwide Research and Development, Groton, CT, USA. li.di@recursionpharma.com.; Recursion Pharmaceutics, Salt Lake City, UT, USA. li.di@recursionpharma.com.

Publikováno v: The AAPS journal [AAPS J] 2024 Dec 10; Vol. 27 (1), pp. 10. Date of Electronic Publication: 2024 Dec 10.

Changes in the plasma protein-binding rate of remifentanil during cardiopulmonary bypass.

Autor: Ueda H; Department of Anesthesiology and Intensive Care, Hamamatsu University School of Medicine, Hamamatsu, Shizuoka, Japan., Kurita T; Department of Anesthesiology and Intensive Care, Hamamatsu University School of Medicine, Hamamatsu, Shizuoka, Japan., Kawashima S; Department of Anesthesiology and Intensive Care, Hamamatsu University School of Medicine, Hamamatsu, Shizuoka, Japan., Kitamoto T; Advanced Research Facilities and Services, Hamamatsu University School of Medicine, Hamamatsu, Shizuoka, Japan., Suzuki M; Advanced Research Facilities and Services, Hamamatsu University School of Medicine, Hamamatsu, Shizuoka, Japan., Nakajima Y; Department of Anesthesiology and Intensive Care, Hamamatsu University School of Medicine, Hamamatsu, Shizuoka, Japan.

Publikováno v: British journal of clinical pharmacology [Br J Clin Pharmacol] 2025 Jan; Vol. 91 (1), pp. 151-156. Date of Electronic Publication: 2024 Sep 09.

The state-of-the-art machine learning model for plasma protein binding prediction: Computational modeling with OCHEM and experimental validation.

Autor: Han Z; State Key Laboratory of Bioactive Substance and Function of Natural Medicines, Institute of Materia Medica, Chinese Academy of Medical Sciences and Peking Union Medical College, Beijing 100050, China., Xia Z; Institute of Structural Biology, Molecular Targets and Therapeutics Center, Helmholtz Munich - German Research Center for Environmental Health (GmbH), Ingolstädter Landstraße 1, 85764 Neuherberg, Germany., Xia J; State Key Laboratory of Bioactive Substance and Function of Natural Medicines, Institute of Materia Medica, Chinese Academy of Medical Sciences and Peking Union Medical College, Beijing 100050, China. Electronic address: jie.william.xia@hotmail.com., Tetko IV; Institute of Structural Biology, Molecular Targets and Therapeutics Center, Helmholtz Munich - German Research Center for Environmental Health (GmbH), Ingolstädter Landstraße 1, 85764 Neuherberg, Germany; BIGCHEM GmbH, Valerystr. 49, 85716 Unterschleißheim, Germany. Electronic address: itetkoai@gmail.com., Wu S; State Key Laboratory of Bioactive Substance and Function of Natural Medicines, Institute of Materia Medica, Chinese Academy of Medical Sciences and Peking Union Medical College, Beijing 100050, China. Electronic address: ws@imm.ac.cn.

Publikováno v: European journal of pharmaceutical sciences : official journal of the European Federation for Pharmaceutical Sciences [Eur J Pharm Sci] 2025 Jan 01; Vol. 204, pp. 106946. Date of Electronic Publication: 2024 Oct 28.

The impact of age and renal function on the pharmacokinetics and protein binding characteristics of fludarabine in paediatric and adult patients undergoing allogeneic haematopoietic stem cell transplantation conditioning.

Autor: Nath CE; Department of Biochemistry, The Children's Hospital at Westmead, Westmead, NSW, 2145, Australia. christa.nath@health.nsw.gov.au.; The Cancer Centre for Children, The Children's Hospital at Westmead, Westmead, NSW, 2145, Australia. christa.nath@health.nsw.gov.au.; Sydney Pharmacy School, University of Sydney, Camperdown, NSW, 2006, Australia. christa.nath@health.nsw.gov.au., Rosser SPA; Department of Biochemistry, The Children's Hospital at Westmead, Westmead, NSW, 2145, Australia.; The Cancer Centre for Children, The Children's Hospital at Westmead, Westmead, NSW, 2145, Australia.; The Children's Hospital at Westmead Clinical School, University of Sydney, Westmead, NSW, 2145, Australia., Nath KK; School of Psychology, Western Sydney University, Kingswood, NSW, 2747, Australia., Chung J; Department of Biochemistry, The Children's Hospital at Westmead, Westmead, NSW, 2145, Australia., Larsen S; Royal Prince Alfred Hospital, Camperdown, NSW, 2006, Australia., Gibson J; Royal Prince Alfred Hospital, Camperdown, NSW, 2006, Australia., Gabriel M; The Cancer Centre for Children, The Children's Hospital at Westmead, Westmead, NSW, 2145, Australia., Shaw PJ; The Cancer Centre for Children, The Children's Hospital at Westmead, Westmead, NSW, 2145, Australia.; The Children's Hospital at Westmead Clinical School, University of Sydney, Westmead, NSW, 2145, Australia., Keogh SJ; The Cancer Centre for Children, The Children's Hospital at Westmead, Westmead, NSW, 2145, Australia.

Publikováno v: European journal of clinical pharmacology [Eur J Clin Pharmacol] 2024 Dec; Vol. 80 (12), pp. 1967-1987. Date of Electronic Publication: 2024 Sep 19.