Compound Detail
CHEMBL464007
BROUSSOFLAVONOL F Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL464007 |
| Name | BROUSSOFLAVONOL F |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KNMMNUQOUANAJS-UHFFFAOYSA-N |
4
Targets
5
Activities
1
Assay Types
0
PK Parameters
8
Publications
0
Known Names
Molecular Properties
422.5
MW (Da)
5.30
ALogP
6
HBA
4
HBD
111.1
PSA (Ų)
0.42
QED
1
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 5 meas. best 5.94
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Hep 3B2 CHEMBL4296437 | IC50 | 5.94 | 5.94 | 1150.0 | 1 |
| NON-PROTEIN TARGET CHEMBL3879801 | IC50 | 5.57 | 5.17 | 2700.0 | 2 |
| Aromatase CHEMBL1978 | IC50 | 5.01 | 5.01 | 9700.0 | 1 |
| HepG2 CHEMBL395 | IC50 | 4.51 | 4.51 | 30790.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Hep 3B2 | IC50 | = | 1150.0 | nM | 5.94 | Cytotoxicity against human Hep3B cells assessed as inhibition of cell proliferat... | 36549116 |
| NON-PROTEIN TARGET | IC50 | = | 2700.0 | nM | 5.57 | Antiplatelet activity against rabbit platelet assessed as inhibition of platelet... | 9358644 |
| Aromatase | IC50 | = | 9700.0 | nM | 5.01 | Inhibition of aromatase from human placental microsomes | 11678652 |
| NON-PROTEIN TARGET | IC50 | = | 16900.0 | nM | 4.77 | Antiplatelet activity against rabbit platelets assessed as arachidonic acid-indu... | 8864236 |
| HepG2 | IC50 | = | 30790.0 | nM | 4.51 | Cytotoxicity against human HepG2 cells assessed as inhibition of cell proliferat... | 36549116 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9358644 | 10.1021/np970186o | NON-PROTEIN TARGET | 8 |
| 8864236 | 10.1021/np960376j | NON-PROTEIN TARGET | 5 |
| 36549116 | 10.1016/j.ejmech.2022.115006 | Hep 3B2 | 5 |
| 11678652 | 10.1021/np010288l | Aromatase | 1 |
| 8864236 | 10.1021/np960376j | Unchecked | 1 |
| 9358644 | 10.1021/np970186o | Brain | 1 |
| 36549116 | 10.1016/j.ejmech.2022.115006 | HepG2 | 1 |
| 36549116 | 10.1016/j.ejmech.2022.115006 | Fibroblast growth factor receptor 1 | 1 |
Data from ChEMBL 36 via Core Engine