Compound Detail
CHEMBL1172560
HYDROXYPHENYL PROPIONIC ACID Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL1172560 |
| Name | HYDROXYPHENYL PROPIONIC ACID |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NMHMNPHRMNGLLB-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
10
Publications
0
Known Names
Molecular Properties
166.2
MW (Da)
1.41
ALogP
2
HBA
2
HBD
57.5
PSA (Ų)
0.71
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 4.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 4.3 | 4.3 | 49530.0 | 1 |
| Spodoptera exigua CHEMBL613321 | IC50 | 4.23 | 4.23 | 58660.0 | 1 |
| Phenol oxidase CHEMBL2366412 | IC50 | 4.07 | 4.07 | 84730.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 49530.0 | nM | 4.3 | Inhibition of PLA2 in hemocytes of Spodoptera exigua fifth-instar larvae using p... | 22447611 |
| Spodoptera exigua | IC50 | = | 58660.0 | nM | 4.23 | Inhibition of immune responses in Spodoptera exigua fifth-instar larvae assessed... | 22447611 |
| Phenol oxidase | IC50 | = | 84730.0 | nM | 4.07 | Inhibition of phenoloxidase activity in hemolymph of Spodoptera exigua fifth-ins... | 22447611 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22447611 | 10.1128/aem.00301-12 | Phenol oxidase | 2 |
| 22447611 | 10.1128/aem.00301-12 | Unchecked | 2 |
| 22447611 | 10.1128/aem.00301-12 | Plutella xylostella | 2 |
| 20565070 | 10.1021/np1000945 | NON-PROTEIN TARGET | 1 |
| 22280363 | 10.1021/jm2016182 | DNA (cytosine-5)-methyltransferase 1 | 1 |
| 22447611 | 10.1128/aem.00301-12 | Spodoptera exigua | 1 |
| 24216089 | 10.1016/j.bmc.2013.10.026 | Radical scavenging activity | 1 |
| 28129991 | 10.1016/j.bmc.2017.01.012 | PI3-kinase p110-alpha/p85-alpha | 1 |
| 28129991 | 10.1016/j.bmc.2017.01.012 | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform | 1 |
| 28495381 | 10.1016/j.bmc.2017.04.037 | Casein kinase II subunit alpha | 1 |
Data from ChEMBL 36 via Core Engine