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. 2019 Feb 21;10:123. doi: 10.3389/fphar.2019.00123

Table 1.

Public databases, algorithms, and software related to TCM network pharmacology.

Type Name Description Website for database or tool Reference
Databases TCM-related databases TCM-Mesh An integration of database and a data-mining system for network pharmacology analysis of TCM preparations http://mesh.tcm.microbioinformatics.org Zhang et al., 2017
TCM database@Taiwan The world’s largest and most comprehensive free small molecular database on TCM for virtual screening http://tcm.cmu.edu.tw Chen, 2011
HIT A comprehensive and fully curated database to complement available resources on protein targets for FDA-approved drugs as well as the promising precursor compounds http://lifecenter.sgst.cn/hit Ye et al., 2011
TCMSP A unique systems pharmacology platform of TCMs that captures the relationships among drugs, targets, and diseases http://lsp.nwu.edu.cn/tcmsp.php Ru et al., 2014
TCMID A comprehensive database that provides information and bridges the gap between TCM and modern life sciences http://www.megabionet.org/tcmid Xue et al., 2013
Drug-related databases A unique bioinformatics and cheminformatics resource that combines detailed drug data with comprehensive drug target information https://www.drugbank.ca Wishart et al., 2006
STITCH A database of known and predicted interactions between chemicals and proteins http://stitch.embl.de Kuhn et al., 2014
ChEMBL An Open Data database containing binding, functional, and ADMET information for a large number of drug-like bioactive compounds https://www.ebi.ac.uk/chembl Gaulton et al., 2012
PubChem A public information system for analyzing the bioactivities of small molecules https://pubchem.ncbi.nlm.nih.gov Wang et al., 2009
Target-related databases STRING A database of known and predicted protein-protein interactions https://string-db.org Szklarczyk et al., 2015
HPRD An object database that integrates a wealth of information relevant to the function of human proteins in health and disease http://www.hprd.org Peri et al., 2003
MINT A database that focuses on experimentally verified protein-protein interactions mined from the scientific literature by expert curators https://mint.bio.uniroma2.it Zanzoni et al., 2002
IntAct A freely available, open-source database system and analysis tool for molecular interaction data https://www.ebi.ac.uk/intact Kerrien et al., 2012
Reactome A free, open-source, curated, and peer-reviewed pathway database https://reactome.org D’Eustachio, 2009
HAPPI An online database of comprehensive human annotated and predicted protein interactions http://discovery.informatics.uab.edu/HAPPI Chen et al., 2009
Disease-related databases OMIM A comprehensive, authoritative compendium of human genes and genetic phenotypes that is freely available and updated daily https://www.omim.org Hamosh et al., 2002
GAD A database of genetic association data from complex diseases and disorders https://geneticassociationdb.nih.gov Becker et al., 2004
Algorithms Random walk An algorithm that predicts potential drug-target interactions on a large scale under the hypothesis that similar drugs often target similar target proteins and the framework of Random Walk https://www.rdocumentation.org/packages/diffusr/versions/0.1.4/topics/random.walk Chen et al., 2012
PRINCE A global, network-based method for prioritizing disease genes and inferring protein complex associations https://github.com/fosterlab/PrInCE Vanunu et al., 2010
Software Cytoscape A software environment for integrated models of biomolecular interaction networks https://cytoscape.org Shannon et al., 2003
Pajek A tool for complex network analysis http://mrvar.fdv.uni-lj.si/pajek Dohleman, 2006

These public databases are categorized into four types: TCM-related, drug-related, target-related, and disease-related. Publicly available tools and visualization software use data from these databases. Websites and references are provided for all of these resources.