Compound Detail
CHEMBL5590994
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Basic Information
| ChEMBL ID | CHEMBL5590994 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CZARTTYSTYGKTQ-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
310.3
MW (Da)
3.82
ALogP
2
HBA
2
HBD
57.4
PSA (Ų)
0.60
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 7.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| High affinity nerve growth factor receptor CHEMBL2815 | IC50 | 7.1 | 6.44 | 80.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| High affinity nerve growth factor receptor | IC50 | = | 80.0 | nM | 7.1 | Inhibition of TRKA (unknown origin) using TK peptide as substrate incubated for ... | 38029466 |
| High affinity nerve growth factor receptor | IC50 | = | 780.0 | nM | 6.11 | Inhibition of TRKA (unknown origin) G595R mutant using TK peptide as substrate i... | 38029466 |
| High affinity nerve growth factor receptor | IC50 | = | 780.0 | nM | 6.11 | Inhibition of TRK (unknown origin) | 39033612 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38029466 | 10.1016/j.ejmech.2023.115953 | High affinity nerve growth factor receptor | 2 |
| 39033612 | 10.1016/j.ejmech.2024.116640 | High affinity nerve growth factor receptor | 1 |
Data from ChEMBL 36 via Core Engine