Compound Detail
CHEMBL5512546
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Basic Information
| ChEMBL ID | CHEMBL5512546 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SGFXZACBHDFTEZ-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
477.0
MW (Da)
3.82
ALogP
8
HBA
2
HBD
98.3
PSA (Ų)
0.45
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 9.37
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mitogen-activated protein kinase kinase kinase kinase 1 CHEMBL5749 | IC50 | 9.37 | 8.295 | 0.4 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mitogen-activated protein kinase kinase kinase kinase 1 | IC50 | = | 0.43 | nM | 9.37 | Inhibition of HPK1 (unknown origin) using His-tagged SLP-76 as substrate preincu... | 38479166 |
| Mitogen-activated protein kinase kinase kinase kinase 1 | IC50 | = | 60.0 | nM | 7.22 | Inhibition of N-terminal nanoluc-fused HPK1 (unknown origin) expressed in HEK293... | 38479166 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38479166 | 10.1016/j.ejmech.2024.116310 | Mitogen-activated protein kinase kinase kinase kinase 1 | 3 |
Data from ChEMBL 36 via Core Engine