Assay Detail
ADMET
CHEMBL4304966
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Inhibition of BACE2 (unknown origin) using Mca-APP Swedish Lys-Met/Asn-Leu mutant-Dnp quencher as substrate by fluorescence assay
15
Total Activities
15
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 Design of Selective β-Site Amyloid Precursor Protein Cleaving Enzyme 1 (BACE1) Inhibitors: Targeting the Flap to Gain Selectivity over BACE2.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 15 | 7.00 | 8.06 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL2347211 | — | — | 1 | 8.06 |
| CHEMBL4463201 | — | — | 1 | 7.89 |
| CHEMBL4582946 | — | — | 1 | 7.85 |
| CHEMBL4535964 | — | — | 1 | 7.68 |
| CHEMBL4473080 | — | — | 1 | 7.55 |
| CHEMBL4587362 | — | — | 1 | 7.13 |
| CHEMBL4568202 | — | — | 1 | 7.11 |
| CHEMBL4561732 | — | — | 1 | 7.07 |
| CHEMBL4563915 | — | — | 1 | 6.99 |
| CHEMBL4592239 | — | — | 1 | 6.89 |
| CHEMBL4451133 | — | — | 1 | 6.60 |
| CHEMBL4536643 | — | — | 1 | 6.50 |
| CHEMBL4583340 | — | — | 1 | 6.20 |
| CHEMBL4443968 | — | — | 1 | 5.78 |
| CHEMBL4465534 | — | — | 1 | 5.68 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL2347211 | — | IC50 | = | 8.7 | nM | 8.06 |
| CHEMBL4463201 | — | IC50 | = | 13.0 | nM | 7.89 |
| CHEMBL4582946 | — | IC50 | = | 14.0 | nM | 7.85 |
| CHEMBL4535964 | — | IC50 | = | 21.0 | nM | 7.68 |
| CHEMBL4473080 | — | IC50 | = | 28.0 | nM | 7.55 |
| CHEMBL4587362 | — | IC50 | = | 74.0 | nM | 7.13 |
| CHEMBL4568202 | — | IC50 | = | 78.0 | nM | 7.11 |
| CHEMBL4561732 | — | IC50 | = | 85.0 | nM | 7.07 |
| CHEMBL4563915 | — | IC50 | = | 102.0 | nM | 6.99 |
| CHEMBL4592239 | — | IC50 | = | 129.0 | nM | 6.89 |
| CHEMBL4451133 | — | IC50 | = | 251.0 | nM | 6.60 |
| CHEMBL4536643 | — | IC50 | = | 316.0 | nM | 6.50 |
| CHEMBL4583340 | — | IC50 | = | 631.0 | nM | 6.20 |
| CHEMBL4443968 | — | IC50 | = | 1660.0 | nM | 5.78 |
| CHEMBL4465534 | — | IC50 | = | 2090.0 | nM | 5.68 |