{"database":"biostudies-other","file_versions":[],"scores":null,"additional":{"omics_type":["Unknown"],"volume":["7"],"submitter":["Zainab Ashimiyu-Abdusalam"],"journal":["ACS omega"],"pagination":["18094-18102"],"species":["Homo sapiens"],"full_dataset_link":["https://www.ebi.ac.uk/biostudies/studies/MODEL2405080004"],"repository":["biostudies-other"],"additional_accession":["35664614"],"pubmed_authors":["Zainab Ashimiyu-Abdusalam","Gemma Turon"]},"is_claimable":false,"name":"Khan2022 - QcrB Inhibition Prediction with Machine Learning Protocol","description":"<p>The cytochrome bcc complex (QcrB) is a subunit of the mycobacterial cyt-bcc-aa3 oxidoreductase, and it has been suggested as a good M.tb target due to the bacteria's dependence on oxidative phosphorylation for its growth. The authors use a dataset of 352 molecules, of which 277 are classified as active (QIM < 1 uM), 58 as moderately active ( 1 > QIM < 20 uM) and 78 as inactive (QIM > 20).</p><p><normal>Model Type:</normal> Predictive machine learning model.<br><normal>Model Relevance:</normal> The model predicts a compound for QcrB Inhibition.<br><normal>Model Encoded by:</normal> Gemma Turon (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/eos24jm\">https://github.com/ersilia-os/eos24jm</a></p><img src=\"https://www.ebi.ac.uk/biomodels/static-assets/images/ersilia-logo.png\" alt=\"Ersilia Logo\" width=\"150\">","dates":{"release":"2024-05-08T00:00:00Z","modification":"2025-07-14T17:02:33.592Z","creation":"2025-03-31T13:25:47.09Z"},"accession":"MODEL2405080004","cross_references":{"mcro":["MCRO:0000009"],"edam":["topic_3336","topic_0154","topic_3474"],"chebi":["CHEBI:33231"],"taxonomy":["1773","9606"],"unknown":["data","eos24jm","OGG_3000887400"],"efo":["0005741"],"stato":["STATO:0000274","STATO:0000233","STATO:0000134","STATO:0000415","STATO:0000524","STATO:0000416","STATO:0000031"],"bao":["0000094","0002305"],"pubmed":["35664614"],"ncit":["NCIT:C3423","NCIT:C78542","NCIT:C61376","NCIT:C16309","C154407","C45329"],"obi":["OBI_0200032"],"cheminf":["CHEMINF:000018"],"omit":["OMIT:0007314"]}}