Yinli Gao

Key Laboratory Of Structure Based Drug Design & Discovery Of Ministry Of Education
Shenyang, 110016, China

Last Updated: 09/26/2026

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Found 11 publications

Design, Synthesis, and Biological Evaluation of Selective PAK4 Degrader for the Treatment of Lung Tumor Metastasis.

Design, Synthesis, and Biological Evaluation of Selective PAK4 Degrader for the Treatment of Lung Tumor Metastasis.

Journal: Journal of medicinal chemistry

Published: May 22, 2025

Design, synthesis, pharmacological evaluation, and computational study of benzo[d] isothiazol-based small molecule inhibitors targeting PD-1/PD-l1 interaction.

Design, synthesis, pharmacological evaluation, and computational study of benzo[d] isothiazol-based small molecule inhibitors targeting PD-1/PD-l1 interaction.

Journal: European journal of medicinal chemistry

Published: March 29, 2024

Structural requirement of RARγ agonism through computational aspects.

Structural requirement of RARγ agonism through computational aspects.

Journal: Journal of molecular modeling

Published: November 18, 2022

Discovery of benzo[d]isothiazole derivatives as novel scaffold inhibitors targeting the programmed cell death-1/programmed cell death-ligand 1 (PD-1/PD-L1) interaction through "ring fusion" strategy.

Discovery of benzo[d]isothiazole derivatives as novel scaffold inhibitors targeting the programmed cell death-1/programmed cell death-ligand 1 (PD-1/PD-L1) interaction through "ring fusion" strategy.

Journal: Bioorganic chemistry

Published: January 14, 2022

Synthesis of selective PAK4 inhibitors for lung metastasis of lung cancer and melanoma cells.

Synthesis of selective PAK4 inhibitors for lung metastasis of lung cancer and melanoma cells.

Journal: Acta pharmaceutica Sinica. B

Published: November 03, 2021

Drug discovery targeting p21-activated kinase 4 (PAK4): a patent review.

Drug discovery targeting p21-activated kinase 4 (PAK4): a patent review.

Journal: Expert opinion on therapeutic patents

Published: August 09, 2021

Systematic analysis of the mechanism of Xiaochaihu decoction in hepatitis B treatment via network pharmacology and molecular docking.

Systematic analysis of the mechanism of Xiaochaihu decoction in hepatitis B treatment via network pharmacology and molecular docking.

Journal: Computers in biology and medicine

Published: August 05, 2021

Revealing the interaction modes of 5-HT2A receptor antagonists and the Structure-Based virtual screening from FDA and TCMNP database.

Revealing the interaction modes of 5-HT2A receptor antagonists and the Structure-Based virtual screening from FDA and TCMNP database.

Journal: Journal of biomolecular structure & dynamics

Published: May 15, 2020

In silico studies on p21-activated kinase 4 inhibitors: comprehensive application of 3D-QSAR analysis, molecular docking, molecular dynamics simulations, and MM-GBSA calculation.

In silico studies on p21-activated kinase 4 inhibitors: comprehensive application of 3D-QSAR analysis, molecular docking, molecular dynamics simulations, and MM-GBSA calculation.

Journal: Journal of biomolecular structure & dynamics

Published: September 27, 2019

Computational Strategy Revealing the Structural Determinant of Ligand Selectivity towards Highly Similar Protein Targets.

Computational Strategy Revealing the Structural Determinant of Ligand Selectivity towards Highly Similar Protein Targets.

Journal: Current drug targets

Published: April 27, 2019

Quinone-thioether metabolites of hydroquinone play a dual role in promoting a vicious cycle of ROS generation: in vitro and in silico insights.

Quinone-thioether metabolites of hydroquinone play a dual role in promoting a vicious cycle of ROS generation: in vitro and in silico insights.

Journal: Archives of toxicology

Published: February 13, 2019

Showing 1-11 of 11

Last Updated: 09/26/2026