Compound Detail
CHEMBL5086921
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Basic Information
| ChEMBL ID | CHEMBL5086921 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YLECAKVNZMDMNS-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
256.2
MW (Da)
3.07
ALogP
2
HBA
2
HBD
66.0
PSA (Ų)
0.74
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 7.62
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Nuclear receptor subfamily 4 group A member 2 CHEMBL5002 | EC50 | 7.62 | 7.62 | 24.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Nuclear receptor subfamily 4 group A member 2 | EC50 | = | 24.0 | nM | 7.62 | Agonist activity at full length NURR1 (unknown origin) expressed in mouse MND9 c... | 33289551 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 33289551 | 10.1021/acs.jmedchem.0c00894 | Nuclear receptor subfamily 4 group A member 2 | 10 |
| 33289551 | 10.1021/acs.jmedchem.0c00894 | Unchecked | 3 |
| 33289551 | 10.1021/acs.jmedchem.0c00894 | SK-N-BE(2) | 1 |
| 33289551 | 10.1021/acs.jmedchem.0c00894 | HEK-293T | 1 |
| 33289551 | 10.1021/acs.jmedchem.0c00894 | PC-12 | 1 |
Data from ChEMBL 36 via Core Engine