Compound Detail
CHEMBL5404727
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Basic Information
| ChEMBL ID | CHEMBL5404727 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SEAMCDPKMLCWSK-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
452.3
MW (Da)
2.93
ALogP
5
HBA
3
HBD
119.8
PSA (Ų)
0.64
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.84
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Egl nine homolog 1 CHEMBL5697 | IC50 | 6.84 | 6.84 | 143.8 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Egl nine homolog 1 | IC50 | = | 143.8 | nM | 6.84 | Binding affinity to full length PHD2 (181 to 426 residues) (unknown origin) by f... | 37367818 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 37367818 | 10.1021/acs.jmedchem.3c00231 | Egl nine homolog 1 | 1 |
Data from ChEMBL 36 via Core Engine