Compound Detail
CHEMBL284116
5-AMINOVALERIC ACID Phase I
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Phase I
Basic Information
| ChEMBL ID | CHEMBL284116 |
| Name | 5-AMINOVALERIC ACID |
| Phase | Phase I |
| Structure Type | MOL |
| InChI Key | JJMDCOVWQOJGCB-UHFFFAOYSA-N |
1
Targets
6
Activities
2
Assay Types
0
PK Parameters
8
Publications
8
Known Names
Molecular Properties
117.2
MW (Da)
0.20
ALogP
2
HBA
2
HBD
63.3
PSA (Ų)
0.52
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Activity Summary
IC50 4 meas. best 4.13
Ki 2 meas.
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sodium- and chloride-dependent GABA transporter 1 CHEMBL5445 | IC50 | 4.13 | 4.13 | 74131.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sodium- and chloride-dependent GABA transporter 1 | IC50 | = | 74131.02 | nM | 4.13 | Inhibition of mouse GAT1-mediated [3H]GABA uptake expressed in human HEK cells | 21353350 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 1619617 | 10.1021/jm00091a009 | Unchecked | 1 |
| 10780899 | 10.1021/jm9904349 | GABA-C receptor | 1 |
| 14667225 | 10.1021/jm030976x | Solute carrier family 15 member 1 | 1 |
| 18528996 | 10.1021/jm7015842 | Gamma-aminobutyric acid receptor subunit rho-1 | 1 |
| 21353350 | 10.1016/j.ejmech.2011.01.042 | Sodium- and chloride-dependent GABA transporter 1 | 1 |
| 21353350 | 10.1016/j.ejmech.2011.01.042 | GABA transporter 3 | 1 |
| 21353350 | 10.1016/j.ejmech.2011.01.042 | GABA transporter 4 | 1 |
| 21353350 | 10.1016/j.ejmech.2011.01.042 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine