Compound Detail
CHEMBL6005276
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Basic Information
| ChEMBL ID | CHEMBL6005276 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZGYGQOBLWQGUEB-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
380.5
MW (Da)
3.32
ALogP
7
HBA
2
HBD
102.5
PSA (Ų)
0.52
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 9.55
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Proto-oncogene tyrosine-protein kinase receptor Ret CHEMBL2041 | IC50 | 9.55 | 9.55 | 0.3 | 1 |
| Proto-oncogene tyrosine-protein kinase Src CHEMBL267 | IC50 | 7.81 | 7.81 | 15.6 | 1 |
| Tyrosine-protein kinase Lck CHEMBL258 | IC50 | 5.78 | 5.78 | 1645.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Proto-oncogene tyrosine-protein kinase receptor Ret | IC50 | = | 0.279 | nM | 9.55 | Measurement of RET Inhibitory Activity (In Vitro): Regarding the conditions for ... | - |
| Proto-oncogene tyrosine-protein kinase Src | IC50 | = | 15.6 | nM | 7.81 | SRC Inhibitory Activity Measurement: Regarding the conditions for measurement of... | - |
| Tyrosine-protein kinase Lck | IC50 | = | 1645.0 | nM | 5.78 | LCK Inhibitory Activity Measurement: Regarding the conditions for measurement of... | - |
Data from ChEMBL 36 via Core Engine