Assay Detail
Binding
CHEMBL1816213
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Inhibition of human intestinal carboxylesterase using o-nitrophenyl acetate as substrate after 5 mins by spectrophotometry
22
Total Activities
22
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
Requirements for mammalian carboxylesterase inhibition by substituted ethane-1,2-diones.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Ki | 22 | 6.72 | 8.24 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL1812859 | — | — | 1 | 8.24 |
| CHEMBL1812858 | — | — | 1 | 7.59 |
| CHEMBL1812864 | — | — | 1 | 7.54 |
| CHEMBL189886 | BENZIL | — | 1 | 7.35 |
| CHEMBL1812863 | — | — | 1 | 7.34 |
| CHEMBL1812856 | — | — | 1 | 7.24 |
| CHEMBL235287 | — | — | 1 | 7.14 |
| CHEMBL1812862 | — | — | 1 | 7.14 |
| CHEMBL1812857 | — | — | 1 | 7.12 |
| CHEMBL1812855 | — | — | 1 | 6.72 |
| CHEMBL1812852 | — | — | 1 | 6.57 |
| CHEMBL1812851 | — | — | 1 | 6.48 |
| CHEMBL1812861 | — | — | 1 | 6.40 |
| CHEMBL192258 | — | — | 1 | 5.74 |
| CHEMBL1812860 | — | — | 1 | 5.62 |
| CHEMBL1812854 | — | — | 1 | 5.33 |
| CHEMBL1812850 | — | — | 1 | 4.67 |
| CHEMBL365809 | BUTANEDIONE | — | 1 | - |
| CHEMBL1812853 | — | — | 1 | - |
| CHEMBL1812849 | DIPHENYL ETHANEDIOAT | — | 1 | - |
| CHEMBL1812848 | — | — | 1 | - |
| CHEMBL1812847 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL1812859 | — | Ki | = | 5.7 | nM | 8.24 |
| CHEMBL1812858 | — | Ki | = | 25.6 | nM | 7.59 |
| CHEMBL1812864 | — | Ki | = | 28.7 | nM | 7.54 |
| CHEMBL189886 | BENZIL | Ki | = | 45.0 | nM | 7.35 |
| CHEMBL1812863 | — | Ki | = | 45.5 | nM | 7.34 |
| CHEMBL1812856 | — | Ki | = | 57.7 | nM | 7.24 |
| CHEMBL235287 | — | Ki | = | 72.0 | nM | 7.14 |
| CHEMBL1812862 | — | Ki | = | 72.7 | nM | 7.14 |
| CHEMBL1812857 | — | Ki | = | 76.4 | nM | 7.12 |
| CHEMBL1812855 | — | Ki | = | 189.0 | nM | 6.72 |
| CHEMBL1812852 | — | Ki | = | 267.0 | nM | 6.57 |
| CHEMBL1812851 | — | Ki | = | 334.0 | nM | 6.48 |
| CHEMBL1812861 | — | Ki | = | 401.0 | nM | 6.40 |
| CHEMBL192258 | — | Ki | = | 1840.0 | nM | 5.74 |
| CHEMBL1812860 | — | Ki | = | 2420.0 | nM | 5.62 |
| CHEMBL1812854 | — | Ki | = | 4670.0 | nM | 5.33 |
| CHEMBL1812850 | — | Ki | = | 21610.0 | nM | 4.67 |
| CHEMBL365809 | BUTANEDIONE | Ki | > | 100000.0 | nM | - |
| CHEMBL1812853 | — | Ki | > | 100000.0 | nM | - |
| CHEMBL1812849 | DIPHENYL ETHANEDIOAT | Ki | > | 100000.0 | nM | - |
| CHEMBL1812848 | — | Ki | > | 100000.0 | nM | - |
| CHEMBL1812847 | — | Ki | > | 100000.0 | nM | - |