Compound Detail
CHEMBL265972
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CO[C@H]1C[C@H]2O[C@@](O)(C(=O)C(=O)N3CCCC[C@H]3C(=O)O[C@H](C(C)C[C@@H]3CC[C@@H](O)[C@H](OC)C3)CC(=O)[C@H](C)/C=C(\C)[C@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)C3C=CC(/C=C/1C)n1c(=O)n(-c4ccccc4)c(=O)n13)[C@H](C)C[C@@H]2OC
Basic Information
| ChEMBL ID | CHEMBL265972 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PCAKWSFRPYRIOO-ZZZSXDPUSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
1119.4
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.92
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Peptidyl-prolyl cis-trans isomerase FKBP1A CHEMBL1902 | Ki | 7.92 | 7.92 | 12.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Peptidyl-prolyl cis-trans isomerase FKBP1A | Ki | = | 12.0 | nM | 7.92 | Compound was tested for its ability to inhibit FK506 binding protein 12 rotamase... | 9857082 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9857082 | 10.1021/jm980307x | Peptidyl-prolyl cis-trans isomerase FKBP1A | 1 |
| 9857082 | 10.1021/jm980307x | Gallus gallus | 1 |
Data from ChEMBL 36 via Core Engine