These tools will no longer be maintained as of December 31, 2024. Archived website can be found here. PubMed4Hh GitHub repository can be found here. Contact NLM Customer Service if you have questions.
9. Bioactivity landscape modeling: chemoinformatic characterization of structure-activity relationships of compounds tested across multiple targets. Waddell J; Medina-Franco JL Bioorg Med Chem; 2012 Sep; 20(18):5443-52. PubMed ID: 22178187 [TBL] [Abstract][Full Text] [Related]
10. Comprehensive analysis of single- and multi-target activity cliffs formed by currently available bioactive compounds. Wassermann AM; Dimova D; Bajorath J Chem Biol Drug Des; 2011 Aug; 78(2):224-8. PubMed ID: 21624090 [TBL] [Abstract][Full Text] [Related]
11. Composition and topology of activity cliff clusters formed by bioactive compounds. Stumpfe D; Dimova D; Bajorath J J Chem Inf Model; 2014 Feb; 54(2):451-61. PubMed ID: 24437577 [TBL] [Abstract][Full Text] [Related]
12. Activity cliff networks for medicinal chemistry. Stumpfe D; Bajorath J Drug Dev Res; 2014 Aug; 75(5):291-8. PubMed ID: 25160069 [TBL] [Abstract][Full Text] [Related]
13. Design of a three-dimensional multitarget activity landscape. de la Vega de León A; Bajorath J J Chem Inf Model; 2012 Nov; 52(11):2876-83. PubMed ID: 23113585 [TBL] [Abstract][Full Text] [Related]
14. Exploration of 3D activity cliffs on the basis of compound binding modes and comparison of 2D and 3D cliffs. Hu Y; Bajorath J J Chem Inf Model; 2012 Mar; 52(3):670-7. PubMed ID: 22394306 [TBL] [Abstract][Full Text] [Related]