Compound Detail
CHEMBL59859
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Basic Information
| ChEMBL ID | CHEMBL59859 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FONKERDJIZSXKE-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
458.6
MW (Da)
4.43
ALogP
3
HBA
2
HBD
67.4
PSA (Ų)
0.67
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.69
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Gastrin/cholecystokinin type B receptor CHEMBL2854 | IC50 | 4.69 | 4.69 | 20390.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Gastrin/cholecystokinin type B receptor | IC50 | = | 20390.0 | nM | 4.69 | Inhibition of binding of [125I]- Bolton-Hunter labeled CCK-8 to CCK-B receptor i... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(97)00356-9 | Cholecystokinin receptor type A | 1 |
| - | 10.1016/S0960-894X(97)00356-9 | Gastrin/cholecystokinin type B receptor | 1 |
| - | 10.1016/S0960-894X(97)00356-9 | Cholecystokinin receptor | 1 |
Data from ChEMBL 36 via Core Engine