Compound Detail
CHEMBL3287814
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Basic Information
| ChEMBL ID | CHEMBL3287814 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DUXIZOUPWNWNDN-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
374.9
MW (Da)
5.96
ALogP
3
HBA
2
HBD
45.1
PSA (Ų)
0.48
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.9
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Pyroglutamylated RF-amide peptide receptor CHEMBL5852 | IC50 | 7.9 | 7.65 | 12.6 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Pyroglutamylated RF-amide peptide receptor | IC50 | = | 12.59 | nM | 7.9 | Antagonist activity at human GPR103 receptor assessed as inhibition of inositol-... | 24900874 |
| Pyroglutamylated RF-amide peptide receptor | IC50 | = | 39.81 | nM | 7.4 | Displacement of [125I]-QRFP43 from human GPR103 receptor overexpressed in HEK me... | 24900874 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24900874 | 10.1021/ml400519h | Pyroglutamylated RF-amide peptide receptor | 2 |
| 24900874 | 10.1021/ml400519h | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine