Compound Detail
CHEMBL3344079
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Basic Information
| ChEMBL ID | CHEMBL3344079 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BULPVMQBJAMSRN-MSOLQXFVSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
415.6
MW (Da)
3.13
ALogP
5
HBA
2
HBD
82.5
PSA (Ų)
0.79
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 2 meas. best 5.49
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| von Hippel-Lindau disease tumor suppressor CHEMBL3108660 | Kd | 5.49 | 5.49 | 3270.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| von Hippel-Lindau disease tumor suppressor | Kd | = | 3270.0 | nM | 5.49 | Binding affinity to N-terminal His6-tagged pVHL (54 to 213 amino acids) (unknown... | 25166285 |
| von Hippel-Lindau disease tumor suppressor | Kd | = | 3270.0 | nM | 5.49 | Binding affinity to VHL E3 ligase (unknown origin) assessed as dissociation cons... | 36206538 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25166285 | 10.1021/jm5011258 | von Hippel-Lindau disease tumor suppressor | 1 |
| 36206538 | 10.1021/acs.jmedchem.2c01491 | von Hippel-Lindau disease tumor suppressor | 1 |
Data from ChEMBL 36 via Core Engine