Assay Detail
ADMET
CHEMBL4268792
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Cytotoxicity against human MRC5 cells after 48 hrs by MTT assay
20
Total Activities
20
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | ADMET |
| Organism | Homo sapiens |
| Cell Type | MRC5 |
| Confidence | 1 — Organism |
| Curated By | Intermediate |
Publication
Discover the leading compound of 4β-S-(5-fluorobenzoxazole)-4-deoxy-4'-demethylepipodophyllotoxin with millimolar-potency toxicity by modifying the molecule structure of 4'-demethylepipodophyllotoxin.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 20 | 4.35 | 4.72 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL4279335 | — | — | 1 | 4.72 |
| CHEMBL31929 | 4'-DEMETHYLEPIPODOPHYLLOTOXIN | — | 1 | 4.67 |
| CHEMBL4290023 | — | — | 1 | 4.55 |
| CHEMBL4277908 | — | — | 1 | 4.49 |
| CHEMBL44657 | ETOPOSIDE | 4.0 | 1 | 4.47 |
| CHEMBL4293402 | — | — | 1 | 4.45 |
| CHEMBL4292654 | — | — | 1 | 4.41 |
| CHEMBL4283746 | — | — | 1 | 4.38 |
| CHEMBL4292996 | — | — | 1 | 4.38 |
| CHEMBL4282789 | — | — | 1 | 4.33 |
| CHEMBL4291578 | — | — | 1 | 4.22 |
| CHEMBL4288172 | — | — | 1 | 4.20 |
| CHEMBL4277530 | — | — | 1 | 4.18 |
| CHEMBL4278265 | — | — | 1 | 4.13 |
| CHEMBL4281364 | — | — | 1 | 4.13 |
| CHEMBL4284775 | — | — | 1 | 4.12 |
| CHEMBL4294488 | — | — | 1 | 4.05 |
| CHEMBL4286595 | — | — | 1 | - |
| CHEMBL4286182 | — | — | 1 | - |
| CHEMBL4289236 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL4279335 | — | IC50 | = | 19000.0 | nM | 4.72 |
| CHEMBL31929 | 4'-DEMETHYLEPIPODOPHYLLOTOXIN | IC50 | = | 21300.0 | nM | 4.67 |
| CHEMBL4290023 | — | IC50 | = | 28100.0 | nM | 4.55 |
| CHEMBL4277908 | — | IC50 | = | 32300.0 | nM | 4.49 |
| CHEMBL44657 | ETOPOSIDE | IC50 | = | 33500.0 | nM | 4.47 |
| CHEMBL4293402 | — | IC50 | = | 35600.0 | nM | 4.45 |
| CHEMBL4292654 | — | IC50 | = | 39000.0 | nM | 4.41 |
| CHEMBL4283746 | — | IC50 | = | 41300.0 | nM | 4.38 |
| CHEMBL4292996 | — | IC50 | = | 41400.0 | nM | 4.38 |
| CHEMBL4282789 | — | IC50 | = | 47000.0 | nM | 4.33 |
| CHEMBL4291578 | — | IC50 | = | 60200.0 | nM | 4.22 |
| CHEMBL4288172 | — | IC50 | = | 63400.0 | nM | 4.20 |
| CHEMBL4277530 | — | IC50 | = | 65400.0 | nM | 4.18 |
| CHEMBL4278265 | — | IC50 | = | 73300.0 | nM | 4.13 |
| CHEMBL4281364 | — | IC50 | = | 73300.0 | nM | 4.13 |
| CHEMBL4284775 | — | IC50 | = | 76300.0 | nM | 4.12 |
| CHEMBL4294488 | — | IC50 | = | 89200.0 | nM | 4.05 |
| CHEMBL4286595 | — | IC50 | = | 136300.0 | nM | - |
| CHEMBL4286182 | — | IC50 | = | 525500.0 | nM | - |
| CHEMBL4289236 | — | IC50 | = | 448900.0 | nM | - |