Assay Detail
ADMET
CHEMBL4821173
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibition of BACE2 (unknown origin) using APP harboring Swedish Lys/Met mutant-derived peptide as substrate incubated for 2 hrs by FRET assay
6
Total Activities
6
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | ADMET |
| Organism | Homo sapiens |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Publication
Structure-Based Approaches to Improving Selectivity through Utilizing Explicit Water Molecules: Discovery of Selective β-Secretase (BACE1) Inhibitors over BACE2.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 6 | 6.61 | 8.72 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL3301601 | VERUBECESTAT | 3.0 | 1 | 8.72 |
| CHEMBL2347203 | — | — | 1 | 6.78 |
| CHEMBL4864591 | — | — | 1 | 6.20 |
| CHEMBL4852444 | — | — | 1 | 5.75 |
| CHEMBL4854629 | — | — | 1 | 5.59 |
| CHEMBL4856391 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL3301601 | VERUBECESTAT | IC50 | = | 1.9 | nM | 8.72 |
| CHEMBL2347203 | — | IC50 | = | 166.0 | nM | 6.78 |
| CHEMBL4864591 | — | IC50 | = | 631.0 | nM | 6.20 |
| CHEMBL4852444 | — | IC50 | = | 1778.0 | nM | 5.75 |
| CHEMBL4854629 | — | IC50 | = | 2570.0 | nM | 5.59 |
| CHEMBL4856391 | — | IC50 | > | 10000.0 | nM | - |