Compound Detail
CHEMBL5184366
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Basic Information
| ChEMBL ID | CHEMBL5184366 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NCWSKRFXEGDDKJ-INIZCTEOSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
393.5
MW (Da)
3.10
ALogP
6
HBA
0
HBD
63.0
PSA (Ų)
0.67
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 1 meas. best 9.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| AP2-associated protein kinase 1 CHEMBL3830 | Kd | 9.0 | 9.0 | 1.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| AP2-associated protein kinase 1 | Kd | = | 1.0 | nM | 9.0 | Binding affinity to AAK1 (unknown origin) assessed as dissociation constant | 33970631 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 33970631 | 10.1021/acs.jmedchem.1c00302 | AP2-associated protein kinase 1 | 1 |
Data from ChEMBL 36 via Core Engine