Assay Detail
Binding
CHEMBL2046256
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Inhibition of recombinant AKR1C2 assessed as NADP+ dependent oxidation of S-tetralol by fluorescence assay
110
Total Activities
110
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Confidence | 8 — Homologous single protein target |
| Curated By | Autocuration |
Target
Aldo-keto reductase family 1 member C2 (CHEMBL5847) ↗| Type | SINGLE PROTEIN |
| Organism | Homo sapiens |
Publication
Development of potent and selective inhibitors of aldo-keto reductase 1C3 (type 5 17β-hydroxysteroid dehydrogenase) based on N-phenyl-aminobenzoates and their structure-activity relationships.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 110 | 5.36 | 6.82 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL22815 | — | — | 1 | 6.82 |
| CHEMBL2043313 | — | — | 1 | 6.72 |
| CHEMBL2043318 | — | — | 1 | 6.72 |
| CHEMBL2043310 | — | — | 1 | 6.66 |
| CHEMBL2043319 | — | — | 1 | 6.57 |
| CHEMBL1574420 | — | — | 1 | 6.55 |
| CHEMBL2043314 | — | — | 1 | 6.55 |
| CHEMBL2043320 | — | — | 1 | 6.54 |
| CHEMBL23588 | FLUFENAMIC ACID | 2.0 | 1 | 6.43 |
| CHEMBL23479 | — | — | 1 | 6.42 |
| CHEMBL2043302 | — | — | 1 | 6.40 |
| CHEMBL2043303 | — | — | 1 | 6.39 |
| CHEMBL23832 | FENAMIC ACID | 1.0 | 1 | 6.36 |
| CHEMBL2041001 | — | — | 1 | 6.31 |
| CHEMBL2043300 | — | — | 1 | 6.29 |
| CHEMBL2043321 | — | — | 1 | 6.27 |
| CHEMBL1596993 | — | — | 1 | 6.16 |
| CHEMBL2040884 | — | — | 1 | 6.16 |
| CHEMBL2043316 | — | — | 1 | 6.06 |
| CHEMBL2043307 | — | — | 1 | 6.04 |
| CHEMBL2043322 | — | — | 1 | 6.04 |
| CHEMBL2041002 | — | — | 1 | 6.04 |
| CHEMBL2040851 | — | — | 1 | 6.01 |
| CHEMBL2043305 | — | — | 1 | 5.97 |
| CHEMBL1328677 | — | — | 1 | 5.96 |
| CHEMBL2043323 | — | — | 1 | 5.96 |
| CHEMBL2043299 | — | — | 1 | 5.89 |
| CHEMBL2040997 | — | — | 1 | 5.88 |
| CHEMBL2043304 | — | — | 1 | 5.84 |
| CHEMBL2043311 | — | — | 1 | 5.83 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL22815 | — | IC50 | = | 150.0 | nM | 6.82 |
| CHEMBL2043318 | — | IC50 | = | 190.0 | nM | 6.72 |
| CHEMBL2043313 | — | IC50 | = | 190.0 | nM | 6.72 |
| CHEMBL2043310 | — | IC50 | = | 220.0 | nM | 6.66 |
| CHEMBL2043319 | — | IC50 | = | 270.0 | nM | 6.57 |
| CHEMBL1574420 | — | IC50 | = | 280.0 | nM | 6.55 |
| CHEMBL2043314 | — | IC50 | = | 280.0 | nM | 6.55 |
| CHEMBL2043320 | — | IC50 | = | 290.0 | nM | 6.54 |
| CHEMBL23588 | FLUFENAMIC ACID | IC50 | = | 370.0 | nM | 6.43 |
| CHEMBL23479 | — | IC50 | = | 380.0 | nM | 6.42 |
| CHEMBL2043302 | — | IC50 | = | 400.0 | nM | 6.40 |
| CHEMBL2043303 | — | IC50 | = | 410.0 | nM | 6.39 |
| CHEMBL23832 | FENAMIC ACID | IC50 | = | 440.0 | nM | 6.36 |
| CHEMBL2041001 | — | IC50 | = | 490.0 | nM | 6.31 |
| CHEMBL2043300 | — | IC50 | = | 510.0 | nM | 6.29 |
| CHEMBL2043321 | — | IC50 | = | 540.0 | nM | 6.27 |
| CHEMBL1596993 | — | IC50 | = | 700.0 | nM | 6.16 |
| CHEMBL2040884 | — | IC50 | = | 700.0 | nM | 6.16 |
| CHEMBL2043316 | — | IC50 | = | 870.0 | nM | 6.06 |
| CHEMBL2041002 | — | IC50 | = | 910.0 | nM | 6.04 |
| CHEMBL2043322 | — | IC50 | = | 910.0 | nM | 6.04 |
| CHEMBL2043307 | — | IC50 | = | 920.0 | nM | 6.04 |
| CHEMBL2040851 | — | IC50 | = | 980.0 | nM | 6.01 |
| CHEMBL2043305 | — | IC50 | = | 1070.0 | nM | 5.97 |
| CHEMBL2043323 | — | IC50 | = | 1110.0 | nM | 5.96 |
| CHEMBL1328677 | — | IC50 | = | 1110.0 | nM | 5.96 |
| CHEMBL2043299 | — | IC50 | = | 1280.0 | nM | 5.89 |
| CHEMBL2040997 | — | IC50 | = | 1330.0 | nM | 5.88 |
| CHEMBL2043304 | — | IC50 | = | 1460.0 | nM | 5.84 |
| CHEMBL2043311 | — | IC50 | = | 1490.0 | nM | 5.83 |
| CHEMBL2043315 | — | IC50 | = | 1470.0 | nM | 5.83 |
| CHEMBL2043301 | — | IC50 | = | 1550.0 | nM | 5.81 |
| CHEMBL2041557 | — | IC50 | = | 1780.0 | nM | 5.75 |
| CHEMBL2040993 | — | IC50 | = | 1880.0 | nM | 5.73 |
| CHEMBL2040891 | — | IC50 | = | 2070.0 | nM | 5.68 |
| CHEMBL2041000 | — | IC50 | = | 2230.0 | nM | 5.65 |
| CHEMBL2043309 | — | IC50 | = | 2360.0 | nM | 5.63 |
| CHEMBL2043312 | — | IC50 | = | 2400.0 | nM | 5.62 |
| CHEMBL2040994 | — | IC50 | = | 2550.0 | nM | 5.59 |
| CHEMBL2040887 | — | IC50 | = | 2670.0 | nM | 5.57 |
| CHEMBL2040999 | — | IC50 | = | 2730.0 | nM | 5.56 |
| CHEMBL2040996 | — | IC50 | = | 2840.0 | nM | 5.55 |
| CHEMBL1682199 | 4-PHENYLAMINO BENZOIC ACID | IC50 | = | 3000.0 | nM | 5.52 |
| CHEMBL2040893 | — | IC50 | = | 3170.0 | nM | 5.50 |
| CHEMBL2040886 | — | IC50 | = | 3240.0 | nM | 5.49 |
| CHEMBL2043306 | — | IC50 | = | 3260.0 | nM | 5.49 |
| CHEMBL1682200 | — | IC50 | = | 3380.0 | nM | 5.47 |
| CHEMBL2043308 | — | IC50 | = | 3400.0 | nM | 5.47 |
| CHEMBL2040995 | — | IC50 | = | 3580.0 | nM | 5.45 |
| CHEMBL2040888 | — | IC50 | = | 3810.0 | nM | 5.42 |