Compound Detail
CHEMBL264131
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COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)CC3OC1C[C@H](NCNC(=O)c2cc(COCC#CCN3C(=O)N(c4ccc(C#N)c(C(F)(F)F)c4)C(=O)C3(C)C)ccc2O)[C@H](O)[C@H](C)O1
Basic Information
| ChEMBL ID | CHEMBL264131 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | TZYXGPPDPJEZFJ-RDMWMZEBSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
1070.0
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.05
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Androgen receptor CHEMBL1871 | IC50 | 7.05 | 7.05 | 90.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Androgen receptor | IC50 | = | 90.0 | nM | 7.05 | Inhibition of [3H]mibolerone binding to human Androgen receptor of PC3/AR Cell L... | 15509168 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15509168 | 10.1021/jm0495226 | Androgen receptor | 2 |
Data from ChEMBL 36 via Core Engine