Compound Detail
CHEMBL292475
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Basic Information
| ChEMBL ID | CHEMBL292475 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HRGYVYLNOUCSJW-UHFFFAOYSA-N |
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
365.4
MW (Da)
3.33
ALogP
5
HBA
0
HBD
55.8
PSA (Ų)
0.79
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 6.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| NON-PROTEIN TARGET CHEMBL3879801 | IC50 | 6.82 | 6.3367 | 150.0 | 3 |
| Telomerase reverse transcriptase CHEMBL2916 | IC50 | 5.16 | 5.16 | 7000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| NON-PROTEIN TARGET | IC50 | = | 150.0 | nM | 6.82 | Compound was evaluated for cytotoxicity against human ovarian cancer cell A2780 | 10999471 |
| NON-PROTEIN TARGET | IC50 | = | 180.0 | nM | 6.75 | Compound was evaluated for cytotoxicity against human ovarian cancer cell CHI | 10999471 |
| NON-PROTEIN TARGET | IC50 | = | 3600.0 | nM | 5.44 | Compound was evaluated for cytotoxicity against human ovarian cancer cell SKOV-3 | 10999471 |
| Telomerase reverse transcriptase | IC50 | = | 7000.0 | nM | 5.16 | Inhibitory activity against human ovarian cancer cell (A2780 cells) Telomerase | 10999471 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10999471 | 10.1016/s0960-894x(00)00378-4 | NON-PROTEIN TARGET | 5 |
| 10999471 | 10.1016/s0960-894x(00)00378-4 | Telomerase reverse transcriptase | 1 |
| - | 10.1007/s00044-011-9594-4 | Telomerase reverse transcriptase | 1 |
Data from ChEMBL 36 via Core Engine