Published December 15, 2015
| Version v1
Dataset
Open
Currently available scaffolds and MMP cores in ChEMBL 20
Authors/Creators
- 1. Department of Life Science Informatics, B-IT, LIMES Program Unit Chemical Biology and Medicinal Chemistry, Rheinische Friedrich-Wilhelms-Universität, Dahlmannstr. 2, D-53113 Bonn, Germany.
Description
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.
Files
Files
(17.8 MB)
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