Compound Detail
CHEMBL5266076
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Basic Information
| ChEMBL ID | CHEMBL5266076 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LUXKEEIMLQRZAH-CVEARBPZSA-N |
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
376.4
MW (Da)
1.49
ALogP
5
HBA
2
HBD
95.9
PSA (Ų)
0.76
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.27
Kd 1 meas. best 4.34
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| von Hippel-Lindau disease tumor suppressor CHEMBL3108660 | Kd | 4.34 | 4.34 | 45500.0 | 1 |
| von Hippel-Lindau disease tumor suppressor CHEMBL3108660 | IC50 | 4.27 | 4.27 | 53200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| von Hippel-Lindau disease tumor suppressor | Kd | = | 45500.0 | nM | 4.34 | Binding affinity to VHL E3 ligase (unknown origin) assessed as dissociation cons... | 36206538 |
| von Hippel-Lindau disease tumor suppressor | IC50 | = | 53200.0 | nM | 4.27 | Binding affinity to VHL E3 ligase (unknown origin) by fluorescence polarization ... | 36206538 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 36206538 | 10.1021/acs.jmedchem.2c01491 | von Hippel-Lindau disease tumor suppressor | 2 |
Data from ChEMBL 36 via Core Engine