# QSPRpred

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An online tool for chemical activity prediction for various endpoints using target-specific and pretrained QSAR models.

![QSPRpred logo](https://raw.githubusercontent.com/VHP4Safety/cloud/main/docs/service/qsprpred.png)

## Documentation

* Service Introduction: [QSPRpred App: Predicting Molecular Initiating Event Activation based on chemical structure](https://github.com/VHP4Safety/vhp4safety-docs/blob/main/tutorials/qsprpred_app/qsprpred_tutorial.md)

* Workflow: To be added

* Demo: To be added

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## VHP4Safety Service Metadata

* Stage: <span class="glossary_term">[https://vhp4safety.github.io/glossary#VHP0000102](https://vhp4safety.github.io/glossary#VHP0000102)</span>

* Sub-stage: <span class="glossary_term">Not available

* Development Cloud: [https://qsprpred.cloud.vhp4safety.nl/](https://qsprpred.cloud.vhp4safety.nl/)

* Login Required: No

* TRL: 3

* Type: internal

* Contact: Linde Schoenmaker (l.schoenmaker@lacdr.leidenuniv.nl)

* API Type: Not available

* Categories: To be added

* Targeted Users: To be added

* Relevant VHP4Safety Use Case: To be added

## Technical Tool Specifications

* Provider: [Department of Medicinal Chemistry,Leiden University]()

* Citation: [10.26434/chemrxiv-2025-jr9v7](https://doi.org/10.26434/chemrxiv-2025-jr9v7)

* Version: Not available

* License: MIT

* Source Code: [https://github.com/VHP4Safety/QSPRpred-Docker](https://github.com/VHP4Safety/QSPRpred-Docker)

* Docker: [https://github.com/VHP4Safety/QSPRpred-Docker](https://github.com/VHP4Safety/QSPRpred-Docker)

* Bio.tools: Not available

* FAIRsharing: Not available

* TeSS: [QSPRpred](QSPRpred)

* RSD: Not available

* Wikipedia: Not available

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