Compound Detail
CHEMBL4757203
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Basic Information
| ChEMBL ID | CHEMBL4757203 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WWPHFXOMYQJGGF-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
338.4
MW (Da)
1.00
ALogP
4
HBA
3
HBD
106.8
PSA (Ų)
0.64
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 9.74
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Pituitary adenylate cyclase-activating polypeptide type I receptor CHEMBL5399 | IC50 | 9.74 | 9.74 | 0.2 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Pituitary adenylate cyclase-activating polypeptide type I receptor | IC50 | = | 0.182 | nM | 9.74 | Antagonist activity at PAC1 receptor (unknown origin) expressed in CHO cells ass... | 31771828 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 31771828 | 10.1016/j.ejmech.2019.111902 | Pituitary adenylate cyclase-activating polypeptide type I receptor | 3 |
| 31771828 | 10.1016/j.ejmech.2019.111902 | Mus musculus | 3 |
| 31771828 | 10.1016/j.ejmech.2019.111902 | Unchecked | 2 |
Data from ChEMBL 36 via Core Engine