Compound Detail
CHEMBL5093381
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Basic Information
| ChEMBL ID | CHEMBL5093381 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NYTIYMREXUPYRJ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
280.3
MW (Da)
2.51
ALogP
3
HBA
2
HBD
75.0
PSA (Ų)
0.71
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 8.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mitogen-activated protein kinase kinase kinase kinase 1 CHEMBL5749 | Ki | 8.82 | 8.82 | 1.5 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mitogen-activated protein kinase kinase kinase kinase 1 | Ki | = | 1.5 | nM | 8.82 | Inhibition of HPK1 (unknown origin) followed by anti-GST antibody incubated for ... | 35059127 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 35059127 | 10.1021/acsmedchemlett.1c00473 | Unchecked | 1 |
| 35059127 | 10.1021/acsmedchemlett.1c00473 | Mitogen-activated protein kinase kinase kinase kinase 1 | 1 |
Data from ChEMBL 36 via Core Engine