Compound Detail
CHEMBL4794090
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Basic Information
| ChEMBL ID | CHEMBL4794090 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IOJFFPCIJQNFCW-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
298.2
MW (Da)
2.55
ALogP
6
HBA
2
HBD
82.3
PSA (Ų)
0.89
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 6.64
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Serine/threonine-protein kinase ULK1 CHEMBL6006 | IC50 | 6.64 | 6.1867 | 230.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Serine/threonine-protein kinase ULK1 | IC50 | = | 230.0 | nM | 6.64 | Inhibition of recombinant human ULK1 (1-649) expressed in Sf9 cells using myelin... | 33200929 |
| Serine/threonine-protein kinase ULK1 | IC50 | = | 1100.0 | nM | 5.96 | ULK1 inhibition assay: Gamma-32P assays to measure ULK1 kinase activity were per... | - |
| Serine/threonine-protein kinase ULK1 | IC50 | = | 1100.0 | nM | 5.96 | ULK1 inhibition assay: ULK1 inhibition assay is a screening assay to identify co... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 33200929 | 10.1021/acs.jmedchem.0c00873 | Serine/threonine-protein kinase ULK1 | 2 |
Data from ChEMBL 36 via Core Engine