Compound Detail
CHEMBL8179
WIN-57294 Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL8179 |
| Name | WIN-57294 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WHXJSJBKDGZVDA-UHFFFAOYSA-N |
2
Targets
8
Activities
2
Assay Types
0
PK Parameters
17
Publications
0
Known Names
Molecular Properties
370.4
MW (Da)
3.99
ALogP
4
HBA
1
HBD
72.2
PSA (Ų)
0.76
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 5 meas. best 5.12
IC50 3 meas. best 4.54
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| DNA topoisomerase II CHEMBL2094255 | EC50 | 5.12 | 5.12 | 7600.0 | 5 |
| P388 CHEMBL389 | IC50 | 4.54 | 4.54 | 29000.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| DNA topoisomerase II | EC50 | = | 7600.0 | nM | 5.12 | Tested for inhibition of topoisomerase II isolated from HeLa cells by DNA-cleava... | 8410993 |
| DNA topoisomerase II | EC50 | = | 7600.0 | nM | 5.12 | Compound was tested for topoisomerase II inhibition in purified HeLa cells by SD... | - |
| DNA topoisomerase II | EC50 | = | 7600.0 | nM | 5.12 | Inhibitory activity against HeLa cell Topoisomerase II | - |
| DNA topoisomerase II | EC50 | = | 7600.0 | nM | 5.12 | Inhibitory activity in a DNA cleavage assay using HeLa DNA topoisomerase II yiel... | 12459024 |
| DNA topoisomerase II | EC50 | = | 7600.0 | nM | 5.12 | Inhibitory activity in a cell-free assay of DNA cleavage mediated by purified He... | - |
| P388 | IC50 | = | 29000.0 | nM | 4.54 | In vitro cytotoxicity against P388 murine leukemia cells in culture in a clonoge... | 8410993 |
| P388 | IC50 | = | 29000.0 | nM | 4.54 | In vitro cytotoxicity was evaluated following 1 hour transient exposure of P388 ... | - |
| P388 | IC50 | = | 29000.0 | nM | 4.54 | In vitro cytotoxicity against P388 mouse leukemia cells | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/0960-894X(95)00160-U | Mus musculus | 2 |
| - | 10.1016/0960-894X(95)00044-T | Mus musculus | 2 |
| - | 10.1016/0960-894X(95)00044-T | DNA topoisomerase II | 1 |
| - | 10.1016/0960-894X(95)00043-S | DNA topoisomerase II | 1 |
| 12459024 | 10.1021/jm010057b | DNA topoisomerase II | 1 |
| - | 10.1016/0960-894X(95)00160-U | P388 | 1 |
| - | 10.1016/0960-894X(95)00160-U | DNA topoisomerase II | 1 |
| - | 10.1016/0960-894X(95)00044-T | DNA topoisomerase 2-beta | 1 |
| - | 10.1016/0960-894X(95)00044-T | P388 | 1 |
| 7629792 | 10.1021/jm00014a005 | Staphylococcus aureus | 1 |
| 8410993 | 10.1021/jm00071a010 | P388 | 1 |
| 8410993 | 10.1021/jm00071a010 | DNA topoisomerase II | 1 |
| 7629792 | 10.1021/jm00014a005 | Bacteroides fragilis | 1 |
| 7629792 | 10.1021/jm00014a005 | Pseudomonas aeruginosa | 1 |
| 7629792 | 10.1021/jm00014a005 | Escherichia coli | 1 |
| 7629792 | 10.1021/jm00014a005 | Streptococcus pyogenes | 1 |
| 7629792 | 10.1021/jm00014a005 | Enterococcus faecalis | 1 |
Data from ChEMBL 36 via Core Engine