Compound Detail
CHEMBL4469569
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Basic Information
| ChEMBL ID | CHEMBL4469569 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FBACRSKJFHDTDV-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
392.3
MW (Da)
5.61
ALogP
2
HBA
1
HBD
42.0
PSA (Ų)
0.59
QED
1
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.48
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| High affinity nerve growth factor receptor CHEMBL2815 | IC50 | 5.48 | 5.48 | 3300.0 | 1 |
| BDNF/NT-3 growth factors receptor CHEMBL4898 | IC50 | 4.57 | 4.57 | 27000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| High affinity nerve growth factor receptor | IC50 | = | 3300.0 | nM | 5.48 | Inhibition of TRKA (unknown origin) | 30188734 |
| BDNF/NT-3 growth factors receptor | IC50 | = | 27000.0 | nM | 4.57 | Inhibition of TRKB (unknown origin) | 30188734 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 30188734 | 10.1021/acs.jmedchem.8b01092 | NT-3 growth factor receptor | 1 |
| 30188734 | 10.1021/acs.jmedchem.8b01092 | BDNF/NT-3 growth factors receptor | 1 |
| 30188734 | 10.1021/acs.jmedchem.8b01092 | High affinity nerve growth factor receptor | 1 |
Data from ChEMBL 36 via Core Engine