---
title: orexin1_receptor_butkiewicz
canonical_url: "https://www.modelscope.cn/datasets/jablonkagroup/orexin1_receptor_butkiewicz"
md_url: "https://www.modelscope.cn/datasets/jablonkagroup/orexin1_receptor_butkiewicz.md"
repository: jablonkagroup/orexin1_receptor_butkiewicz
last_updated: 2025-05-28
license: "Apache License 2.0"
storage_size: "48 MB"
downloads: 649
stars: 0
---

# orexin1_receptor_butkiewicz

> orexin1_receptor_butkiewicz - jablonkagroup 在 ModelScope 开源的数据集。"GPCR Orexin 1 is relevant for behavioral plasticity, the sleep-wake cycle, and gastric acid secretion.Three primary screens, AID 485270, AID 463079, AID 434989, were performed. Validation assay…

jablonkagroup/orexin1_receptor_butkiewicz 是 ModelScope 魔搭社区上的数据集，存储大小 48 MB，采用 Apache License 2.0 许可。

- **Repository**: jablonkagroup/orexin1_receptor_butkiewicz
- **License**: Apache License 2.0
- **Storage size**: 48 MB
- **Downloads**: 649
- **Stars**: 0
- **Last updated**: 2025-05-28

Source: https://www.modelscope.cn/datasets/jablonkagroup/orexin1_receptor_butkiewicz

---

## Dataset Details

### Dataset Description

"GPCR Orexin 1 is relevant for behavioral plasticity,
the sleep-wake cycle, and gastric acid secretion.Three primary screens,
AID 485270, AID 463079, AID 434989, were performed. Validation assay
AID504701, AD492963. Counter screen 493232. More specific assay
AID504699. AID504701 and AID504699 were combined to identify 234 active
compounds excluding an overlap of 155 molecules.

- **Curated by:**
- **License:** CC BY 4.0

### Dataset Sources

- [original dataset](https://tdcommons.ai/single_pred_tasks/hts/#butkiewicz-et-al)
- [corresponding publication](https://doi.org/10.3390/molecules18010735)
- [corresponding publication](https://doi.org/10.1093/nar/gky1033)
- [corresponding publication](https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5962024/)

## 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:**

```bibtex
@article{Butkiewicz2013,
doi = {10.3390/molecules18010735},
url = {https://doi.org/10.3390/molecules18010735},
year = {2013},
month = jan,
publisher = {{MDPI} {AG}},
volume = {18},
number = {1},
pages = {735--756},
author = {Mariusz Butkiewicz and Edward Lowe and Ralf Mueller and
Jeffrey Mendenhall and Pedro Teixeira and C. Weaver and Jens
Meiler},
title = {Benchmarking Ligand-Based Virtual High-Throughput
Screening with the {PubChem} Database},
journal = {Molecules}}
@article{Kim2018,
doi = {10.1093/nar/gky1033},
url = {https://doi.org/10.1093/nar/gky1033},
year = {2018},
month = oct,
publisher = {Oxford University Press ({OUP})},
volume = {47},
number = {D1},
pages = {D1102--D1109},
author = {Sunghwan Kim and Jie Chen and Tiejun Cheng and Asta
Gindulyte and Jia He and Siqian He and Qingliang Li and Benjamin
A Shoemaker and Paul A Thiessen and Bo Yu and Leonid Zaslavsky
and Jian Zhang and Evan E Bolton},
title = {{PubChem} 2019 update: improved access to chemical data},
journal = {Nucleic Acids Research}}
@article{Butkiewicz2017,
doi = {},
url = {https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5962024/},
year = {2017},
publisher = {Chem Inform},
volume = {3},
number = {1},
author = {Butkiewicz, M. and Wang, Y. and Bryant, S. H. and Lowe,
E. W. and Weaver, D. C. and Meiler, J.},
title = {{H}igh-{T}hroughput {S}creening {A}ssay {D}atasets from
the {P}ub{C}hem {D}atabase}},
journal = {Chemical Science}}
```