Assay Detail
Binding
CHEMBL901540
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Inhibition of Clostridium botulinum A recombinant light chain protease LC/A by FRET assay
18
Total Activities
18
Compounds Tested
2
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Clostridium botulinum |
| Confidence | 0 — Uncurated / Unknown |
| Curated By | Autocuration |
Publication
Synthesis and structure-activity relationships of second-generation hydroxamate botulinum neurotoxin A protease inhibitors.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 17 | 5.12 | 6.22 |
| Activity | 1 | - | - |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL395360 | — | — | 1 | 6.22 |
| CHEMBL235653 | — | — | 1 | 6.16 |
| CHEMBL237776 | — | — | 1 | 6.10 |
| CHEMBL237370 | CINNAMIC ACID HYDROXAMATE | — | 1 | 6.05 |
| CHEMBL237778 | — | — | 1 | 5.70 |
| CHEMBL394106 | — | — | 1 | 5.36 |
| CHEMBL237129 | — | — | 1 | 5.29 |
| CHEMBL235863 | — | — | 1 | 5.05 |
| CHEMBL237990 | — | — | 1 | 4.92 |
| CHEMBL237777 | — | — | 1 | 4.89 |
| CHEMBL237989 | — | — | 1 | 4.77 |
| CHEMBL238398 | — | — | 1 | 4.68 |
| CHEMBL237775 | — | — | 1 | 4.60 |
| CHEMBL235862 | — | — | 1 | 4.42 |
| CHEMBL235860 | — | — | 1 | 4.39 |
| CHEMBL394105 | — | — | 1 | 4.35 |
| CHEMBL394104 | — | — | 1 | 4.15 |
| CHEMBL235861 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL395360 | — | IC50 | = | 600.0 | nM | 6.22 |
| CHEMBL235653 | — | IC50 | = | 700.0 | nM | 6.16 |
| CHEMBL237776 | — | IC50 | = | 800.0 | nM | 6.10 |
| CHEMBL237370 | CINNAMIC ACID HYDROXAMATE | IC50 | = | 900.0 | nM | 6.05 |
| CHEMBL237778 | — | IC50 | = | 2000.0 | nM | 5.70 |
| CHEMBL394106 | — | IC50 | = | 4400.0 | nM | 5.36 |
| CHEMBL237129 | — | IC50 | = | 5100.0 | nM | 5.29 |
| CHEMBL235863 | — | IC50 | = | 9000.0 | nM | 5.05 |
| CHEMBL237990 | — | IC50 | = | 12000.0 | nM | 4.92 |
| CHEMBL237777 | — | IC50 | = | 13000.0 | nM | 4.89 |
| CHEMBL237989 | — | IC50 | = | 17000.0 | nM | 4.77 |
| CHEMBL238398 | — | IC50 | = | 21000.0 | nM | 4.68 |
| CHEMBL237775 | — | IC50 | = | 25000.0 | nM | 4.60 |
| CHEMBL235862 | — | IC50 | = | 38000.0 | nM | 4.42 |
| CHEMBL235860 | — | IC50 | = | 41000.0 | nM | 4.39 |
| CHEMBL394105 | — | IC50 | = | 45000.0 | nM | 4.35 |
| CHEMBL394104 | — | IC50 | = | 71000.0 | nM | 4.15 |
| CHEMBL235861 | — | Activity | - | — | - |