jablonkagroup/herg_central_inhib
Dataset Details Dataset Description Human ether-à-go-go related gene (hERG) is crucial for the coordination of the heart's beating. Thus, if a drug blocks the hERG, it could lead to severe adverse effects. Therefore, reliable prediction of hERG liability in the early stages of drug design is quite important to reduce the risk of cardiotoxicity-related attritions in the later development stages. There are three targets: hERG_at_1microM, hERG_at_10microM, and… See the full description on the dataset page: https://huggingface.co/datasets/jablonkagroup/herg_central_inhib.
Dataset Details
Dataset Description
Human ether-à-go-go related gene (hERG) is crucial for the coordination of the heart's beating. Thus, if a drug blocks the hERG, it could lead to severe adverse effects. Therefore, reliable prediction of hERG liability in the early stages of drug design is quite important to reduce the risk of cardiotoxicity-related attritions in the later development stages. There are three targets: hERGat1microM, hERGat10microM, and herg_inhib.
- Curated by:
- License: CC BY 4.0
Dataset Sources
Citation
<!-- If there is a paper or blog post introducing the dataset, the APA and Bibtex information for that should go in this section. -->
BibTeX:
@article{Du2011,
doi = {10.1089/adt.2011.0425},
url = {https://doi.org/10.1089/adt.2011.0425},
year = {2011},
month = dec,
publisher = {Mary Ann Liebert Inc},
volume = {9},
number = {6},
pages = {580--588},
author = {Fang Du and Haibo Yu and Beiyan Zou and Joseph Babcock
and Shunyou Long and Min Li},
title = {hERGCentral: A Large Database to Store, Retrieve, and Analyze Compound Human
Ether-à-go-go Related Gene Channel Interactions to Facilitate Cardiotoxicity Assessment in Drug Development},
journal = {ASSAY and Drug Development Technologies}