GenUI: interactive and extensible open source software platform for de novo molecular generation and cheminformatics.
PMID:34563271
Will the chemical probes please stand up?
PMID:34447939
Drug combination therapy for emerging viral diseases.
PMID:34023496
Online informatics resources to facilitate cancer target and chemical probe discovery.
PMID:33479663
Structural analysis, virtual screening and molecular simulation to identify potential inhibitors targeting 2'-O-ribose methyltransferase of SARS-CoV-2 coronavirus.
PMID:33016237
Kinase inhibitor data set for systematic analysis of representative kinases across the human kinome.
PMID:32904416
Revealing new therapeutic opportunities through drug target prediction: a class imbalance-tolerant machine learning approach.
PMID:32399556
Exploration of databases and methods supporting drug repurposing: a comprehensive survey.
PMID:32055842
ABC-transporter upregulation mediates resistance to the CDK7 inhibitors THZ1 and ICEC0942.
PMID:31530935
In Silico Toxicology Data Resources to Support Read-Across and (Q)SAR.
PMID:31244651
DrugCentral 2018: an update.
PMID:30371892
Probing the chemical-biological relationship space with the Drug Target Explorer.
PMID:30128806
Collection of analog series-based scaffolds from public compound sources.
PMID:29682322
ICBS 2017 in Shanghai-Illuminating Life with Chemical Innovation.
PMID:29677443
Chemical probes and drug leads from advances in synthetic planning and methodology.
PMID:29651105
The SGC beyond structural genomics: redefining the role of 3D structures by coupling genomic stratification with fragment-based discovery.
PMID:29118096