Compound Detail
CHEMBL4796271
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Basic Information
| ChEMBL ID | CHEMBL4796271 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ILDNHGDMFHLNNS-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
512.8
MW (Da)
7.32
ALogP
4
HBA
1
HBD
56.8
PSA (Ų)
0.29
QED
2
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.5
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| STE20/SPS1-related proline-alanine-rich protein kinase CHEMBL1163108 | IC50 | 5.5 | 5.5 | 3200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| STE20/SPS1-related proline-alanine-rich protein kinase | IC50 | = | 3200.0 | nM | 5.5 | Inhibition of SPAK (unknown origin) by ELISA | 32738993 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 32738993 | 10.1016/j.bmcl.2020.127408 | STE20/SPS1-related proline-alanine-rich protein kinase | 1 |
Data from ChEMBL 36 via Core Engine