Compound Detail
CHEMBL5591390
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Basic Information
| ChEMBL ID | CHEMBL5591390 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZDMHXTUPOVNHMX-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
398.4
MW (Da)
3.23
ALogP
5
HBA
3
HBD
88.3
PSA (Ų)
0.59
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.54
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| High affinity nerve growth factor receptor CHEMBL2815 | IC50 | 6.54 | 6.54 | 290.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| High affinity nerve growth factor receptor | IC50 | = | 290.0 | nM | 6.54 | Inhibition of TRKA G595R mutant (unknown origin) using TK as substrate incubated... | 39033612 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 39033612 | 10.1016/j.ejmech.2024.116640 | High affinity nerve growth factor receptor | 1 |
Data from ChEMBL 36 via Core Engine