Assay Detail
Binding
CHEMBL3118331
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Inhibition of human ALDH3A1-mediated benzaldehyde oxidation preincubated for 1 min followed by substrate addition by spectrophotometric analysis
24
Total Activities
24
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 |
Target
Aldehyde dehydrogenase, dimeric NADP-preferring (CHEMBL3578) ↗| Type | SINGLE PROTEIN |
| Organism | Homo sapiens |
Publication
Selective ALDH3A1 inhibition by benzimidazole analogues increase mafosfamide sensitivity in cancer cells.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 24 | 5.88 | 6.70 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL1378094 | — | — | 1 | 6.70 |
| CHEMBL3112681 | — | — | 1 | 6.52 |
| CHEMBL3112688 | — | — | 1 | 6.16 |
| CHEMBL1411903 | — | — | 1 | 6.16 |
| CHEMBL1308268 | — | — | 1 | 6.05 |
| CHEMBL3112689 | — | — | 1 | 6.05 |
| CHEMBL1492620 | — | — | 1 | 6.00 |
| CHEMBL1521474 | — | — | 1 | 5.92 |
| CHEMBL1493289 | — | — | 1 | 5.82 |
| CHEMBL1607749 | — | — | 1 | 5.70 |
| CHEMBL1890994 | — | — | 1 | 5.68 |
| CHEMBL3112687 | — | — | 1 | 5.38 |
| CHEMBL1519988 | — | — | 1 | 4.30 |
| CHEMBL1729716 | — | — | 1 | - |
| CHEMBL3112680 | — | — | 1 | - |
| CHEMBL3112683 | — | — | 1 | - |
| CHEMBL3112679 | — | — | 1 | - |
| CHEMBL3112682 | — | — | 1 | - |
| CHEMBL1372362 | — | — | 1 | - |
| CHEMBL3112684 | — | — | 1 | - |
| CHEMBL1561479 | — | — | 1 | - |
| CHEMBL3112685 | — | — | 1 | - |
| CHEMBL3112686 | — | — | 1 | - |
| CHEMBL1413180 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL1378094 | — | IC50 | = | 200.0 | nM | 6.70 |
| CHEMBL3112681 | — | IC50 | = | 300.0 | nM | 6.52 |
| CHEMBL3112688 | — | IC50 | = | 700.0 | nM | 6.16 |
| CHEMBL1411903 | — | IC50 | = | 700.0 | nM | 6.16 |
| CHEMBL1308268 | — | IC50 | = | 900.0 | nM | 6.05 |
| CHEMBL3112689 | — | IC50 | = | 900.0 | nM | 6.05 |
| CHEMBL1492620 | — | IC50 | = | 1000.0 | nM | 6.00 |
| CHEMBL1521474 | — | IC50 | = | 1200.0 | nM | 5.92 |
| CHEMBL1493289 | — | IC50 | = | 1500.0 | nM | 5.82 |
| CHEMBL1607749 | — | IC50 | = | 2000.0 | nM | 5.70 |
| CHEMBL1890994 | — | IC50 | = | 2100.0 | nM | 5.68 |
| CHEMBL3112687 | — | IC50 | = | 4200.0 | nM | 5.38 |
| CHEMBL1519988 | — | IC50 | = | 50000.0 | nM | 4.30 |
| CHEMBL1729716 | — | IC50 | > | 100000.0 | nM | - |
| CHEMBL3112680 | — | IC50 | > | 100000.0 | nM | - |
| CHEMBL3112683 | — | IC50 | > | 100000.0 | nM | - |
| CHEMBL3112679 | — | IC50 | > | 50000.0 | nM | - |
| CHEMBL3112682 | — | IC50 | > | 100000.0 | nM | - |
| CHEMBL1372362 | — | IC50 | > | 100000.0 | nM | - |
| CHEMBL3112684 | — | IC50 | > | 100000.0 | nM | - |
| CHEMBL1561479 | — | IC50 | > | 100000.0 | nM | - |
| CHEMBL3112685 | — | IC50 | > | 100000.0 | nM | - |
| CHEMBL3112686 | — | IC50 | > | 100000.0 | nM | - |
| CHEMBL1413180 | — | IC50 | > | 100000.0 | nM | - |