Assay Detail
Binding
CHEMBL1838643
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Inhibition of C-terminal histidine-tagged caspase-3 using Ac-DEVD-AMC coumarin-120 as substrate after 20 mins by fluorometric analysis
24
Total Activities
24
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Confidence | 8 — Homologous single protein target |
| Curated By | Autocuration |
Publication
Exploiting differences in caspase-2 and -3 S₂ subsites for selectivity: structure-based design, solid-phase synthesis and in vitro activity of novel substrate-based caspase-2 inhibitors.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 24 | 5.81 | 7.92 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL1835210 | — | — | 1 | 7.92 |
| CHEMBL1835209 | — | — | 1 | 7.82 |
| CHEMBL1835322 | — | — | 1 | 7.58 |
| CHEMBL1835208 | — | — | 1 | 7.54 |
| CHEMBL1835211 | — | — | 1 | 7.23 |
| CHEMBL1835324 | — | — | 1 | 6.63 |
| CHEMBL1835321 | — | — | 1 | 6.54 |
| CHEMBL1835403 | — | — | 1 | 6.04 |
| CHEMBL1835404 | — | — | 1 | 5.97 |
| CHEMBL1835325 | — | — | 1 | 5.85 |
| CHEMBL1835319 | — | — | 1 | 5.56 |
| CHEMBL1835317 | — | — | 1 | 5.53 |
| CHEMBL1835399 | — | — | 1 | 5.52 |
| CHEMBL1835320 | — | — | 1 | 5.39 |
| CHEMBL1835313 | — | — | 1 | 5.29 |
| CHEMBL1835212 | — | — | 1 | 5.26 |
| CHEMBL1835400 | — | — | 1 | 5.10 |
| CHEMBL1835314 | — | — | 1 | 5.03 |
| CHEMBL1835316 | — | — | 1 | 5.00 |
| CHEMBL1835318 | — | — | 1 | 4.98 |
| CHEMBL1835315 | — | — | 1 | 4.65 |
| CHEMBL1835402 | — | — | 1 | 4.64 |
| CHEMBL1835401 | — | — | 1 | 4.23 |
| CHEMBL1835323 | — | — | 1 | 4.09 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL1835210 | — | IC50 | = | 12.0 | nM | 7.92 |
| CHEMBL1835209 | — | IC50 | = | 15.0 | nM | 7.82 |
| CHEMBL1835322 | — | IC50 | = | 26.0 | nM | 7.58 |
| CHEMBL1835208 | — | IC50 | = | 29.0 | nM | 7.54 |
| CHEMBL1835211 | — | IC50 | = | 59.0 | nM | 7.23 |
| CHEMBL1835324 | — | IC50 | = | 233.0 | nM | 6.63 |
| CHEMBL1835321 | — | IC50 | = | 289.0 | nM | 6.54 |
| CHEMBL1835403 | — | IC50 | = | 907.0 | nM | 6.04 |
| CHEMBL1835404 | — | IC50 | = | 1075.0 | nM | 5.97 |
| CHEMBL1835325 | — | IC50 | = | 1410.0 | nM | 5.85 |
| CHEMBL1835319 | — | IC50 | = | 2765.0 | nM | 5.56 |
| CHEMBL1835317 | — | IC50 | = | 2925.0 | nM | 5.53 |
| CHEMBL1835399 | — | IC50 | = | 3000.0 | nM | 5.52 |
| CHEMBL1835320 | — | IC50 | = | 4075.0 | nM | 5.39 |
| CHEMBL1835313 | — | IC50 | = | 5125.0 | nM | 5.29 |
| CHEMBL1835212 | — | IC50 | = | 5533.0 | nM | 5.26 |
| CHEMBL1835400 | — | IC50 | = | 7970.0 | nM | 5.10 |
| CHEMBL1835314 | — | IC50 | = | 9300.0 | nM | 5.03 |
| CHEMBL1835316 | — | IC50 | = | 9920.0 | nM | 5.00 |
| CHEMBL1835318 | — | IC50 | = | 10400.0 | nM | 4.98 |
| CHEMBL1835315 | — | IC50 | = | 22500.0 | nM | 4.65 |
| CHEMBL1835402 | — | IC50 | = | 23000.0 | nM | 4.64 |
| CHEMBL1835401 | — | IC50 | = | 58600.0 | nM | 4.23 |
| CHEMBL1835323 | — | IC50 | = | 81500.0 | nM | 4.09 |