Compound Detail
CHEMBL3577010
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Basic Information
| ChEMBL ID | CHEMBL3577010 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DBAIDFYIOZZVFL-ZPUQHVIOSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
236.3
MW (Da)
2.77
ALogP
3
HBA
0
HBD
42.9
PSA (Ų)
0.77
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.46
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Nuclear factor NF-kappa-B p105 subunit CHEMBL3251 | IC50 | 5.46 | 5.46 | 3500.0 | 1 |
| Transcription factor Jun CHEMBL4977 | IC50 | 5.09 | 5.09 | 8200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Nuclear factor NF-kappa-B p105 subunit | IC50 | = | 3500.0 | nM | 5.46 | Cellular Firefly Luciferase Assay (NFkB): The NF-kB activities of curcumin and a... | - |
| Transcription factor Jun | IC50 | = | 8200.0 | nM | 5.09 | Cellular Firefly Luciferase Assay (AP-1): Curcumin is a known inhibitor of the A... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25961334 | 10.1021/acs.jmedchem.5b00470 | PC-3 | 2 |
| 25961334 | 10.1021/acs.jmedchem.5b00470 | DU-145 | 2 |
| 25961334 | 10.1021/acs.jmedchem.5b00470 | LNCaP | 2 |
| 25961334 | 10.1021/acs.jmedchem.5b00470 | HeLa | 2 |
Data from ChEMBL 36 via Core Engine