Compound Detail
CHEMBL300814
FLAVANONE Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL300814 |
| Name | FLAVANONE |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GSAOUZGPXSGVRS-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
7
Publications
0
Known Names
Molecular Properties
254.2
MW (Da)
2.87
ALogP
4
HBA
2
HBD
70.7
PSA (Ų)
0.65
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.06
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Aromatase CHEMBL1978 | IC50 | 8.06 | 8.06 | 8.7 | 1 |
| Aldo-keto reductase family 1 member B1 CHEMBL3081 | IC50 | 5.4 | 5.4 | 3980.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Aromatase | IC50 | = | 8.7 | nM | 8.06 | Inhibition of human placental microsome CYP19 | 20413308 |
| Aldo-keto reductase family 1 member B1 | IC50 | = | 3980.0 | nM | 5.4 | Inhibition of ALR2 (aldose reductase) of bovine lens | 10354396 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10354396 | 10.1021/jm980441h | Aldo-keto reductase family 1 member B1 | 1 |
| 10354396 | 10.1021/jm980441h | No relevant target | 1 |
| 17189684 | 10.1016/j.bmcl.2006.12.029 | Human immunodeficiency virus 1 | 1 |
| 20413308 | 10.1016/j.bmcl.2010.03.113 | Aromatase | 1 |
| 21073191 | 10.1021/jm101206p | BDNF/NT-3 growth factors receptor | 1 |
| 23062825 | 10.1016/j.bmc.2012.09.040 | Acetylcholinesterase | 1 |
| 23062825 | 10.1016/j.bmc.2012.09.040 | Cholinesterase | 1 |
Data from ChEMBL 36 via Core Engine