Compound Detail
CHEMBL4851115
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COc1cc(N2CCC(NC(=O)CCCCCCCCCC(=O)N[C@@H](C(=O)N3C[C@H](O)C[C@H]3C(=O)NCc3ccc(-c4scnc4C)cc3)C(C)(C)C)CC2)ccc1Nc1ncc(Cl)c(Nc2ccccc2P(C)(C)=O)n1
Basic Information
| ChEMBL ID | CHEMBL4851115 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DYUJLNPTOOBZBB-OZQVWOLWSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
1111.8
MW (Da)
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 8.96
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| SR CHEMBL614300 | IC50 | 8.96 | 8.96 | 1.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| SR | IC50 | = | 1.1 | nM | 8.96 | Antiproliferative activity against ALK positive human SR cells | 33751979 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 33751979 | 10.1016/j.ejmech.2021.113335 | SR | 1 |
Data from ChEMBL 36 via Core Engine