Compound Detail
CHEMBL3678958
RUSERONTINIB 🧪 Phase III
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🧪 Phase III
Basic Information
| ChEMBL ID | CHEMBL3678958 |
| Name | RUSERONTINIB |
| Phase | Phase III |
| Structure Type | MOL |
| InChI Key | WSOHOUHPUOAXIN-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
4
Known Names
2
Indications
3
Mechanisms
Molecular Properties
443.6
MW (Da)
4.04
ALogP
9
HBA
2
HBD
87.0
PSA (Ų)
0.46
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Mechanism of Action
| Mechanism | Action Type | Target | Direct | Efficacy |
|---|---|---|---|---|
| Epidermal growth factor receptor erbB1 inhibitor | INHIBITOR | Epidermal growth factor receptor | ✓ | ✓ |
| Tyrosine-protein kinase receptor FLT3 inhibitor | INHIBITOR | Receptor-type tyrosine-protein kinase FLT3 | ✓ | ✓ |
| Tyrosine-protein kinase ABL inhibitor | INHIBITOR | Tyrosine-protein kinase ABL1 | ✓ | ✓ |
Indications
Leukemia, Myeloid, Acute Neoplasms
Activity Summary
IC50 3 meas. best 8.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Epidermal growth factor receptor CHEMBL203 | IC50 | 8.4 | 7.7 | 4.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Epidermal growth factor receptor | IC50 | = | 4.0 | nM | 8.4 | Inhibition Assay: The object of this assay was to test the inventive compounds f... | - |
| Epidermal growth factor receptor | IC50 | = | 31.0 | nM | 7.51 | Inhibition Assay: The object of this assay was to test the inventive compounds f... | - |
| Epidermal growth factor receptor | IC50 | = | 64.0 | nM | 7.19 | Inhibition Assay: The object of this assay was to test the inventive compounds f... | - |
Data from ChEMBL 36 via Core Engine