Compound Detail
CHEMBL5931928
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Basic Information
| ChEMBL ID | CHEMBL5931928 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IFMCEWXRLHTEPH-UHFFFAOYSA-N |
2
Targets
6
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
412.5
MW (Da)
1.55
ALogP
8
HBA
2
HBD
135.7
PSA (Ų)
0.52
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 6 meas. best 8.05
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Proto-oncogene tyrosine-protein kinase receptor Ret CHEMBL2041 | IC50 | 8.05 | 6.785 | 9.0 | 4 |
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 5.02 | 5.02 | 9490.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Proto-oncogene tyrosine-protein kinase receptor Ret | IC50 | = | 9.0 | nM | 8.05 | Time-Resolved Fluorescence Transfer (FRET) Assay: RET and KDR: Kinase activity w... | - |
| Proto-oncogene tyrosine-protein kinase receptor Ret | IC50 | = | 9.0 | nM | 8.05 | RET and KDR Enzyme Assay: Kinase activity was detected using CisBio HTRF kinEASE... | - |
| Proto-oncogene tyrosine-protein kinase receptor Ret | IC50 | = | 3000.0 | nM | 5.52 | Time-Resolved Fluorescence Transfer (FRET) Assay: RET and KDR: Kinase activity w... | - |
| Proto-oncogene tyrosine-protein kinase receptor Ret | IC50 | = | 3000.0 | nM | 5.52 | RET and KDR Enzyme Assay: Kinase activity was detected using CisBio HTRF kinEASE... | - |
| Vascular endothelial growth factor receptor 2 | IC50 | = | 9490.0 | nM | 5.02 | Time-Resolved Fluorescence Transfer (FRET) Assay: RET and KDR: Kinase activity w... | - |
| Vascular endothelial growth factor receptor 2 | IC50 | = | 9490.0 | nM | 5.02 | RET and KDR Enzyme Assay: Kinase activity was detected using CisBio HTRF kinEASE... | - |
Data from ChEMBL 36 via Core Engine