Assay Detail
Binding
CHEMBL828284
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibition constant against human liver carboxylesterase 1 (hCE1) using nitrophenyl acetate (o-NPA) as substrate
61
Total Activities
61
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Homo sapiens |
| Confidence | 9 — Direct single protein target |
| Curated By | Expert |
Publication
Identification and characterization of novel benzil (diphenylethane-1,2-dione) analogues as inhibitors of mammalian carboxylesterases.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Ki | 61 | 6.24 | 8.10 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL362996 | — | — | 1 | 8.10 |
| CHEMBL189886 | BENZIL | — | 1 | 7.35 |
| CHEMBL192180 | — | — | 1 | 7.32 |
| CHEMBL193229 | — | — | 1 | 7.13 |
| CHEMBL192241 | — | — | 1 | 7.11 |
| CHEMBL192627 | CHLORANIL | — | 1 | 7.08 |
| CHEMBL365161 | — | — | 1 | 7.05 |
| CHEMBL193140 | — | — | 1 | 7.00 |
| CHEMBL371858 | — | — | 1 | 6.90 |
| CHEMBL192252 | — | — | 1 | 6.80 |
| CHEMBL192474 | — | — | 1 | 6.76 |
| CHEMBL192139 | — | — | 1 | 6.74 |
| CHEMBL192589 | — | — | 1 | 6.67 |
| CHEMBL192410 | — | — | 1 | 6.64 |
| CHEMBL191847 | — | — | 1 | 6.53 |
| CHEMBL193180 | — | — | 1 | 6.43 |
| CHEMBL370059 | — | — | 1 | 6.28 |
| CHEMBL192625 | — | — | 1 | 6.27 |
| CHEMBL435109 | — | — | 1 | 5.81 |
| CHEMBL365392 | — | — | 1 | 5.78 |
| CHEMBL195713 | — | — | 1 | 5.77 |
| CHEMBL191822 | — | — | 1 | 5.48 |
| CHEMBL191513 | — | — | 1 | 5.47 |
| CHEMBL192258 | — | — | 1 | 5.28 |
| CHEMBL364729 | — | — | 1 | 5.26 |
| CHEMBL190677 | BENZOIN | -1.0 | 1 | 5.14 |
| CHEMBL364734 | — | — | 1 | 4.82 |
| CHEMBL364588 | — | — | 1 | 4.77 |
| CHEMBL191796 | — | — | 1 | 4.74 |
| CHEMBL371523 | DIBENZOYLMETHANE | -1.0 | 1 | 4.58 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL362996 | — | Ki | = | 8.0 | nM | 8.10 |
| CHEMBL189886 | BENZIL | Ki | = | 45.1 | nM | 7.35 |
| CHEMBL192180 | — | Ki | = | 47.4 | nM | 7.32 |
| CHEMBL193229 | — | Ki | = | 73.5 | nM | 7.13 |
| CHEMBL192241 | — | Ki | = | 77.6 | nM | 7.11 |
| CHEMBL192627 | CHLORANIL | Ki | = | 83.9 | nM | 7.08 |
| CHEMBL365161 | — | Ki | = | 88.6 | nM | 7.05 |
| CHEMBL193140 | — | Ki | = | 99.1 | nM | 7.00 |
| CHEMBL371858 | — | Ki | = | 125.0 | nM | 6.90 |
| CHEMBL192252 | — | Ki | = | 160.0 | nM | 6.80 |
| CHEMBL192474 | — | Ki | = | 175.0 | nM | 6.76 |
| CHEMBL192139 | — | Ki | = | 182.0 | nM | 6.74 |
| CHEMBL192589 | — | Ki | = | 215.0 | nM | 6.67 |
| CHEMBL192410 | — | Ki | = | 231.0 | nM | 6.64 |
| CHEMBL191847 | — | Ki | = | 295.0 | nM | 6.53 |
| CHEMBL193180 | — | Ki | = | 372.0 | nM | 6.43 |
| CHEMBL370059 | — | Ki | = | 524.0 | nM | 6.28 |
| CHEMBL192625 | — | Ki | = | 532.0 | nM | 6.27 |
| CHEMBL435109 | — | Ki | = | 1540.0 | nM | 5.81 |
| CHEMBL365392 | — | Ki | = | 1650.0 | nM | 5.78 |
| CHEMBL195713 | — | Ki | = | 1690.0 | nM | 5.77 |
| CHEMBL191822 | — | Ki | = | 3300.0 | nM | 5.48 |
| CHEMBL191513 | — | Ki | = | 3410.0 | nM | 5.47 |
| CHEMBL192258 | — | Ki | = | 5270.0 | nM | 5.28 |
| CHEMBL364729 | — | Ki | = | 5440.0 | nM | 5.26 |
| CHEMBL190677 | BENZOIN | Ki | = | 7250.0 | nM | 5.14 |
| CHEMBL364734 | — | Ki | = | 15300.0 | nM | 4.82 |
| CHEMBL364588 | — | Ki | = | 16900.0 | nM | 4.77 |
| CHEMBL191796 | — | Ki | = | 18100.0 | nM | 4.74 |
| CHEMBL371523 | DIBENZOYLMETHANE | Ki | = | 26000.0 | nM | 4.58 |
| CHEMBL191800 | — | Ki | > | 100000.0 | nM | - |
| CHEMBL365129 | — | Ki | > | 100000.0 | nM | - |
| CHEMBL284028 | 2,3-DIHYDROXY-6,7-DICHLOROQUINOXALINE | Ki | > | 100000.0 | nM | - |
| CHEMBL192712 | — | Ki | > | 100000.0 | nM | - |
| CHEMBL8320 | BENZOQUINONE | Ki | > | 100000.0 | nM | - |
| CHEMBL193228 | — | Ki | > | 100000.0 | nM | - |
| CHEMBL190496 | — | Ki | > | 100000.0 | nM | - |
| CHEMBL189988 | BENZYLSULFONYLBENZENE | Ki | > | 100000.0 | nM | - |
| CHEMBL365809 | BUTANEDIONE | Ki | > | 100000.0 | nM | - |
| CHEMBL191676 | — | Ki | > | 100000.0 | nM | - |
| CHEMBL372856 | — | Ki | > | 100000.0 | nM | - |
| CHEMBL192657 | — | Ki | > | 100000.0 | nM | - |
| CHEMBL192039 | — | Ki | > | 100000.0 | nM | - |
| CHEMBL366205 | — | Ki | > | 100000.0 | nM | - |
| CHEMBL425192 | — | Ki | > | 100000.0 | nM | - |
| CHEMBL365517 | — | Ki | > | 100000.0 | nM | - |
| CHEMBL90039 | BENZOPHENONE | Ki | > | 100000.0 | nM | - |
| CHEMBL191739 | — | Ki | > | 100000.0 | nM | - |
| CHEMBL192648 | — | Ki | > | 100000.0 | nM | - |
| CHEMBL365982 | — | Ki | > | 100000.0 | nM | - |