Compound Detail
CHEMBL6013201
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Basic Information
| ChEMBL ID | CHEMBL6013201 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | TTZAURANQVEMPE-UHFFFAOYSA-N |
4
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
470.5
MW (Da)
4.45
ALogP
8
HBA
2
HBD
88.3
PSA (Ų)
0.57
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 8.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Macrophage colony-stimulating factor 1 receptor CHEMBL1844 | IC50 | 8.1 | 8.1 | 8.0 | 1 |
| Cyclin-dependent kinase 4 CHEMBL331 | IC50 | 7.7 | 7.7 | 20.0 | 1 |
| Cyclin-dependent kinase 6 CHEMBL2508 | IC50 | 7.35 | 7.35 | 45.0 | 1 |
| Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform CHEMBL3130 | IC50 | 6.23 | 6.23 | 589.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Macrophage colony-stimulating factor 1 receptor | IC50 | = | 8.0 | nM | 8.1 | LanthaScreen Eu Kinase Binding Assay: FMS: IC50 values of compounds against FMS ... | - |
| Cyclin-dependent kinase 4 | IC50 | = | 20.0 | nM | 7.7 | In Vitro Kinase Inhibition Assay: CDK4 and CDK6: IC50 values of compounds agains... | - |
| Cyclin-dependent kinase 6 | IC50 | = | 45.0 | nM | 7.35 | In Vitro Kinase Inhibition Assay: CDK4 and CDK6: IC50 values of compounds agains... | - |
| Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform | IC50 | = | 589.0 | nM | 6.23 | Activity Assay: PI3Kδ: Briefly, this assay was conducted in buffer (Tris-HCl 40 ... | - |
Data from ChEMBL 36 via Core Engine