biostudies-otherUnknown49Zainab Ashimiyu-AbdusalamDrug metabolism and disposition: the biological fate of chemicals822-832Homo sapienshttps://www.ebi.ac.uk/biostudies/studies/MODEL2404160003biostudies-other34183376Zainab Ashimiyu-AbdusalamfalseGonzalez2021 - QSAR Prediction Model for CYP2D6 Inhibitor and Substrate<p>Analysis of metabolic stability, determining the inhibition of CYP2D6 activity and whether the compounds are a substrate for the CYP2D6 enzyme. The data used to build these models has been publicly available at PubChem (AID1645840) by ADME@NCATS.</p><p><normal>Model Type:</normal> Predictive machine learning model.<br><normal>Model Relevance:</normal> Probability of inhibiting the CYP2D6 enzyme and probability of being a substrate of the enzyme<br><normal>Model Encoded by:</normal> Zakia Yahya (Ersilia)<br><normal>Metadata Submitted in BioModels by:</normal> Zainab Ashimiyu-Abdusalam</p><p>Implementation of this model code by <a href="https://ersilia.io/">Ersilia</a> is available here: <br><a href="https://github.com/ersilia-os/eos7nno">https://github.com/ersilia-os/eos7nno</a></p><img src="https://www.ebi.ac.uk/biomodels/static-assets/images/ersilia-logo.png" alt="Ersilia Logo" width="150">2024-04-16T00:00:00Z2025-07-14T17:02:57.88Z2025-03-31T13:25:21.529ZMODEL2404160003STATO:0000233STATO:0000134STATO:0000415STATO:0000524STATO:0000549STATO:000003100100950000009000230534183376NCIT:C16484NCIT:C16309NCIT:C26517NCIT:C17429C45329C154407NCIT:C19404NCIT:C79371topic_3336topic_3474OBI_0200032CHEMINF:0000189606OMIT:0028701OMIT:0028710ncats-adme1645840datahomeeos7nno