Assay Detail
Binding
CHEMBL3119479
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibition of human thrombin using S-2366 as substrate preincubated for 300 seconds followed by substrate addition measured after 40 mins by spectrophotometric analysis
19
Total Activities
19
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Homo sapiens |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Publication
Design, synthesis, and SAR of a series of activated protein C (APC) inhibitors with selectivity against thrombin for the treatment of haemophilia.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 19 | 5.37 | 8.40 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL266349 | MELAGATRAN | 4.0 | 1 | 8.40 |
| CHEMBL3115901 | — | — | 1 | 6.05 |
| CHEMBL3115904 | — | — | 1 | 5.89 |
| CHEMBL3115905 | — | — | 1 | 5.72 |
| CHEMBL3115903 | — | — | 1 | 5.43 |
| CHEMBL3115902 | — | — | 1 | 5.42 |
| CHEMBL3115900 | — | — | 1 | 5.41 |
| CHEMBL3115899 | — | — | 1 | 5.28 |
| CHEMBL3115906 | — | — | 1 | 5.28 |
| CHEMBL3115897 | — | — | 1 | 5.21 |
| CHEMBL3115907 | — | — | 1 | 5.16 |
| CHEMBL3115898 | — | — | 1 | 4.92 |
| CHEMBL3115893 | — | — | 1 | 4.92 |
| CHEMBL3115894 | — | — | 1 | 4.66 |
| CHEMBL3115892 | — | — | 1 | 4.58 |
| CHEMBL3115896 | — | — | 1 | 4.55 |
| CHEMBL215295 | — | — | 1 | 4.44 |
| CHEMBL3115891 | — | — | 1 | - |
| CHEMBL3115895 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL266349 | MELAGATRAN | IC50 | = | 4.0 | nM | 8.40 |
| CHEMBL3115901 | — | IC50 | = | 900.0 | nM | 6.05 |
| CHEMBL3115904 | — | IC50 | = | 1300.0 | nM | 5.89 |
| CHEMBL3115905 | — | IC50 | = | 1900.0 | nM | 5.72 |
| CHEMBL3115903 | — | IC50 | = | 3700.0 | nM | 5.43 |
| CHEMBL3115902 | — | IC50 | = | 3800.0 | nM | 5.42 |
| CHEMBL3115900 | — | IC50 | = | 3900.0 | nM | 5.41 |
| CHEMBL3115899 | — | IC50 | = | 5200.0 | nM | 5.28 |
| CHEMBL3115906 | — | IC50 | = | 5200.0 | nM | 5.28 |
| CHEMBL3115897 | — | IC50 | = | 6100.0 | nM | 5.21 |
| CHEMBL3115907 | — | IC50 | = | 7000.0 | nM | 5.16 |
| CHEMBL3115898 | — | IC50 | = | 12000.0 | nM | 4.92 |
| CHEMBL3115893 | — | IC50 | = | 12000.0 | nM | 4.92 |
| CHEMBL3115894 | — | IC50 | = | 22000.0 | nM | 4.66 |
| CHEMBL3115892 | — | IC50 | = | 26000.0 | nM | 4.58 |
| CHEMBL3115896 | — | IC50 | = | 28000.0 | nM | 4.55 |
| CHEMBL215295 | — | IC50 | = | 36000.0 | nM | 4.44 |
| CHEMBL3115891 | — | IC50 | > | 44000.0 | nM | - |
| CHEMBL3115895 | — | IC50 | > | 44000.0 | nM | - |