Currently available scaffolds and MMP cores in ChEMBL 20
| Main Authors: | Hu, Ye, Stumpfe, Dagmar, Bajorath, Jürgen |
|---|---|
| Format: | info dataset Journal |
| Terbitan: |
, 2015
|
| Online Access: |
https://zenodo.org/record/35375 |
Daftar Isi:
- All target-based BM scaffolds (Ki: 35,872; IC50: 74,379), CSKs (Ki: 23,056; IC50: 49,216), MMP cores (Ki: 42,104; IC50: 73,616), and retrosynthetic MMP cores (Ki: 19,040; IC50: 32,382) for high confident bioactive compounds extracted from ChEMBL version 20 are provided herein.