Compound Detail
CHEMBL5821302
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL5821302 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JHQIXXCRTMLJDW-FQEVSTJZSA-N |
1
Targets
6
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
341.4
MW (Da)
4.21
ALogP
4
HBA
1
HBD
71.9
PSA (Ų)
0.85
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 6 meas. best 9.17
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| AP2-associated protein kinase 1 CHEMBL3830 | IC50 | 9.17 | 9.17 | 0.7 | 6 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| AP2-associated protein kinase 1 | IC50 | = | 0.68 | nM | 9.17 | AAK1 Kinase Assay: The assays were performed in U-bottom 384-well plates. The fi... | - |
| AP2-associated protein kinase 1 | IC50 | = | 0.68 | nM | 9.17 | Kinase Assay: The assays were performed in U-bottom 384-well plates. The final a... | - |
| AP2-associated protein kinase 1 | IC50 | = | 0.68 | nM | 9.17 | AAK1 Kinase Assay: The assays were performed in U-bottom 384-well plates. The fi... | - |
| AP2-associated protein kinase 1 | IC50 | = | 0.68 | nM | 9.17 | AAK1 Kinase Assay: The assays were performed in U-bottom 384-well plates. The fi... | - |
| AP2-associated protein kinase 1 | IC50 | = | 0.68 | nM | 9.17 | Kinase Assay: The assays were performed in U-bottom 384-well plates. The final a... | - |
| AP2-associated protein kinase 1 | IC50 | = | 0.68 | nM | 9.17 | AAK1 Kinase Assay: The assays were performed in U-bottom 384-well plates. The fi... | - |
Data from ChEMBL 36 via Core Engine