Target Structure Modeling and Prediction
TargetMol | Copyrighted software
One-stop SolutionAn AI-powered drug discovery platformto facilitate the identification of PCC.
TargetMol | Copyrighted software
Expert TeamUtilizing multiple professional softwaretools and proprietary algorithms.
TargetMol | Copyrighted software
Extensive DatabasesAccess to tens of millions of real,purchasable compounds
TargetMol | Copyrighted software
Rich Project ExperienceProviding products and services tothousands of organizations worldwide
Introduction to Target Fishing
Target Fishing

Target Fishing

Target fishing is a computational approach used to identify potential biological targets for a given drug or active small molecule.

Studies have shown that most known drugs act on multiple targets rather than a single one.

Multi-target activity is both the root cause of drug side effects and the basis for discovering new therapeutic effects. Therefore, predicting drug targets and exploring target–disease relationships are effective strategies for advancing disease treatment.

Based on comprehensive target databases, we have successfully developed a reverse virtual screening platform. This platform provides services including target identification and validation for compounds, investigation of novel drug activities, and analysis of drug toxicity and side effects. In addition, we offer integrated access to target-related information from databases such as PubMed, EC, UniProt, CAS, and DrugBank, along with detailed insights into target active sites.

Target Database Resources
Target Screening Library CategoriesNumber of TargetsNumber of Active SitesDatabase Description
Whole Target Database1402119Fully Resolved Crystal Structures of Disease-Associated Targets
part Target Database5065487Partially Resolved Structures of Disease-Associated Targets
scPDB Target Database35369275733 Human Targets, with Data Sourced from the scPDB Database
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Virtual Screening
Molecular Docking
Molecular Dynamics
Target Fishing
Calculation Parameters
QSAR Model
Homology Modeling
Other

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TargetMol | Target Loading
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