Compound Detail
CHEMBL402361
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Basic Information
| ChEMBL ID | CHEMBL402361 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SGWQLKZDRSCUTH-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
400.5
MW (Da)
3.63
ALogP
7
HBA
2
HBD
76.4
PSA (Ų)
0.53
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 8.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Interleukin-1 receptor-associated kinase 4 CHEMBL3778 | IC50 | 8.1 | 8.1 | 8.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Interleukin-1 receptor-associated kinase 4 | IC50 | = | 8.0 | nM | 8.1 | Inhibition of IRAK4 | 18501603 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18501603 | 10.1016/j.bmcl.2008.04.042 | Interleukin-1 receptor-associated kinase 4 | 1 |
Data from ChEMBL 36 via Core Engine