December 15, 2025 Dataset Open Access

Emanuel S.R. Ehmki; Torben Gutermuth; Tobias Harren; Stefan Kurtz; Matthias Rarey

JSON Export

{"conceptdoi":"10.25592/uhhfdm.18142","conceptrecid":"18142","created":"2025-12-17T08:45:15.582534+00:00","doi":"10.25592/uhhfdm.18143","id":18143,"links":{"badge":"https://www.fdr.uni-hamburg.de/badge/doi/10.25592/uhhfdm.18143.svg","conceptbadge":"https://www.fdr.uni-hamburg.de/badge/doi/10.25592/uhhfdm.18142.svg","conceptdoi":"http://doi.org/10.25592/uhhfdm.18142","doi":"http://doi.org/10.25592/uhhfdm.18143"},"metadata":{"access_right":"open","access_right_category":"success","communities":[{"id":"uhh"}],"creators":[{"affiliation":"University of Hamburg, ZBH - Center for Bioinformatics, Albert Einstein Ring 8-10, 22761 Hamburg, Germany","name":"Emanuel S.R. Ehmki","orcid":"0000-0003-0457-4856"},{"affiliation":"University of Hamburg, ZBH - Center for Bioinformatics, Albert Einstein Ring 8-10, 22761 Hamburg, Germany","name":"Torben Gutermuth","orcid":"0000-0002-9304-8251"},{"affiliation":"University of Hamburg, ZBH - Center for Bioinformatics, Albert Einstein Ring 8-10, 22761 Hamburg, Germany","name":"Tobias Harren","orcid":"0009-0004-1221-7765"},{"affiliation":"University of Hamburg, ZBH - Center for Bioinformatics, Albert Einstein Ring 8-10, 22761 Hamburg, Germany","name":"Stefan Kurtz","orcid":"0000-0001-5783-0054"},{"affiliation":"University of Hamburg, ZBH - Center for Bioinformatics, Albert Einstein Ring 8-10, 22761 Hamburg, Germany","name":"Matthias Rarey","orcid":"0000-0002-9553-6531"}],"description":"<p>Three supporting data files for the Activityfinder publication are given here.<br>\nTwo are redundantly saved and also present in the journal article: the unwanted ligand list and the amino acid mapping used for the Activityfinder.<br>\nAdditionally, a database dump of the complete ActivityDB used for the publication is provided.</p>","doi":"10.25592/uhhfdm.18143","keywords":["Dataset, Bioactivities, ChEMBL, PDB"],"license":{"id":"CC-BY-NC-SA-3.0"},"publication_date":"2025-12-15","related_identifiers":[{"identifier":"10.1021/acs.jcim.5c02505","relation":"isSupplementTo","scheme":"doi"},{"identifier":"10.25592/uhhfdm.18142","relation":"isVersionOf","scheme":"doi"}],"relations":{"version":[{"count":1,"index":0,"is_last":true,"last_child":{"pid_type":"recid","pid_value":"18143"},"parent":{"pid_type":"recid","pid_value":"18142"}}]},"resource_type":{"title":"Dataset","type":"dataset"},"title":"Supporting Information for the ActivityFinder publication","version":"1.0.0"},"owners":[858],"revision":2,"updated":"2025-12-27T21:23:55.110771+00:00"}