Fuqiang Ban

2660 Oak Street, V6H 3Z6
Vancouver, BC, Canada

Last Updated: 09/26/2026

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Found 56 publications

CACHE Challenge #3: Targeting the Nsp3 Macrodomain of SARS-CoV-2.

CACHE Challenge #3: Targeting the Nsp3 Macrodomain of SARS-CoV-2.

Journal: Journal of chemical information and modeling

Published: January 21, 2026

Deep docking, part 2: an amplified DDU platform for ultra-large virtual screening.

Deep docking, part 2: an amplified DDU platform for ultra-large virtual screening.

Journal: Chemical science

Published: December 08, 2025

Structure-based discovery of inhibitors of Mac1 domain of nonstructural protein-3 of SARS-CoV-2 by machine learning-augmented screening of chemical space.

Structure-based discovery of inhibitors of Mac1 domain of nonstructural protein-3 of SARS-CoV-2 by machine learning-augmented screening of chemical space.

Journal: bioRxiv : the preprint server for biology

Published: September 18, 2025

Active Learning-Guided Hit Optimization for the Leucine-Rich Repeat Kinase 2 WDR Domain Based on In Silico Ligand-Binding Affinities.

Active Learning-Guided Hit Optimization for the Leucine-Rich Repeat Kinase 2 WDR Domain Based on In Silico Ligand-Binding Affinities.

Journal: Journal of chemical information and modeling

Published: May 26, 2025

Pharmacokinetics, pathology and efficacy of SARS-CoV-2 main protease inhibitor VPC285785 in a murine model of coronavirus infection.

Pharmacokinetics, pathology and efficacy of SARS-CoV-2 main protease inhibitor VPC285785 in a murine model of coronavirus infection.

Journal: Scientific reports

Published: May 08, 2025

CACHE Challenge #1: Targeting the WDR Domain of LRRK2, A Parkinson's Disease Associated Protein.

CACHE Challenge #1: Targeting the WDR Domain of LRRK2, A Parkinson's Disease Associated Protein.

Journal: Journal of chemical information and modeling

Published: November 05, 2024

5'-S-(3-Aminophenyl)-5'-thioadenosine, a Novel Chemoprotective Agent for Reducing Toxic Side Effects of Fluorouracil in Treatment of MTAP-Deficient Cancers.

5'-S-(3-Aminophenyl)-5'-thioadenosine, a Novel Chemoprotective Agent for Reducing Toxic Side Effects of Fluorouracil in Treatment of MTAP-Deficient Cancers.

Journal: Molecular cancer therapeutics

Published: August 02, 2024

PROTACable Is an Integrative Computational Pipeline of 3-D Modeling and Deep Learning To Automate the De Novo Design of PROTACs.

PROTACable Is an Integrative Computational Pipeline of 3-D Modeling and Deep Learning To Automate the De Novo Design of PROTACs.

Journal: Journal of chemical information and modeling

Published: March 20, 2024

Characterization of novel small molecule inhibitors of estrogen receptor-activation function 2 (ER-AF2).

Characterization of novel small molecule inhibitors of estrogen receptor-activation function 2 (ER-AF2).

Journal: Breast cancer research : BCR

Published: March 04, 2024

In silico screening of LRRK2 WDR domain inhibitors using deep docking and free energy simulations.

In silico screening of LRRK2 WDR domain inhibitors using deep docking and free energy simulations.

Journal: Chemical science

Published: December 21, 2023

A novel class of broad-spectrum active-site-directed 3C-like protease inhibitors with nanomolar antiviral activity against highly immune-evasive SARS-CoV-2 Omicron subvariants.

A novel class of broad-spectrum active-site-directed 3C-like protease inhibitors with nanomolar antiviral activity against highly immune-evasive SARS-CoV-2 Omicron subvariants.

Journal: Emerging microbes & infections

Published: August 09, 2023

Large-Scale Virtual Screening for the Discovery of SARS-CoV-2 Papain-like Protease (PLpro) Non-covalent Inhibitors.

Large-Scale Virtual Screening for the Discovery of SARS-CoV-2 Papain-like Protease (PLpro) Non-covalent Inhibitors.

Journal: Journal of chemical information and modeling

Published: March 17, 2023

Showing 1-12 of 56

Last Updated: 09/26/2026