Assay Detail
Binding
CHEMBL657984
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In vitro inhibition of porcine carboxylesterase.
21
Total Activities
21
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Confidence | 8 — Homologous single protein target |
| Curated By | Expert |
Publication
Use of ab initio calculations to predict the biological potency of carboxylesterase inhibitors.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 21 | 6.57 | 9.34 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL155514 | — | — | 1 | 9.34 |
| CHEMBL440542 | — | — | 1 | 8.08 |
| CHEMBL155513 | — | — | 1 | 7.98 |
| CHEMBL153080 | — | — | 1 | 7.77 |
| CHEMBL421992 | — | — | 1 | 7.36 |
| CHEMBL153015 | — | — | 1 | 6.94 |
| CHEMBL155396 | — | — | 1 | 6.77 |
| CHEMBL153177 | — | — | 1 | 6.42 |
| CHEMBL155621 | — | — | 1 | 6.17 |
| CHEMBL152225 | — | — | 1 | 5.03 |
| CHEMBL152843 | — | — | 1 | 4.67 |
| CHEMBL152698 | — | — | 1 | 4.61 |
| CHEMBL152376 | — | — | 1 | 4.22 |
| CHEMBL153107 | — | — | 1 | - |
| CHEMBL152577 | — | — | 1 | - |
| CHEMBL150821 | — | — | 1 | - |
| CHEMBL153601 | — | — | 1 | - |
| CHEMBL153556 | — | — | 1 | - |
| CHEMBL356917 | — | — | 1 | - |
| CHEMBL150648 | — | — | 1 | - |
| CHEMBL47127 | 2-DECANONE | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL155514 | — | IC50 | = | 0.4571 | nM | 9.34 |
| CHEMBL440542 | — | IC50 | = | 8.318 | nM | 8.08 |
| CHEMBL155513 | — | IC50 | = | 10.47 | nM | 7.98 |
| CHEMBL153080 | — | IC50 | = | 16.98 | nM | 7.77 |
| CHEMBL421992 | — | IC50 | = | 43.65 | nM | 7.36 |
| CHEMBL153015 | — | IC50 | = | 114.82 | nM | 6.94 |
| CHEMBL155396 | — | IC50 | = | 169.82 | nM | 6.77 |
| CHEMBL153177 | — | IC50 | = | 380.19 | nM | 6.42 |
| CHEMBL155621 | — | IC50 | = | 676.08 | nM | 6.17 |
| CHEMBL152225 | — | IC50 | = | 9332.54 | nM | 5.03 |
| CHEMBL152843 | — | IC50 | = | 21379.62 | nM | 4.67 |
| CHEMBL152698 | — | IC50 | = | 24547.09 | nM | 4.61 |
| CHEMBL152376 | — | IC50 | = | 60255.96 | nM | 4.22 |
| CHEMBL153107 | — | IC50 | = | 977237.22 | nM | - |
| CHEMBL152577 | — | IC50 | = | 109647.82 | nM | - |
| CHEMBL150821 | — | IC50 | = | 154881.66 | nM | - |
| CHEMBL153601 | — | IC50 | = | 851138.04 | nM | - |
| CHEMBL153556 | — | IC50 | = | 257039.58 | nM | - |
| CHEMBL356917 | — | IC50 | = | 954992.59 | nM | - |
| CHEMBL150648 | — | IC50 | = | 6456542.29 | nM | - |
| CHEMBL47127 | 2-DECANONE | IC50 | = | 67608297.54 | nM | - |