Compound Detail
CHEMBL297534
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Basic Information
| ChEMBL ID | CHEMBL297534 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QYPQPHZJHKGOLX-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
444.5
MW (Da)
4.26
ALogP
4
HBA
1
HBD
75.7
PSA (Ų)
0.61
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.12
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cholecystokinin receptor CHEMBL2096986 | IC50 | 8.12 | 8.12 | 7.5 | 1 |
| Cholecystokinin receptor type A CHEMBL2871 | IC50 | 8.12 | 8.12 | 7.5 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cholecystokinin receptor | IC50 | = | 7.5 | nM | 8.12 | Half-maximal inhibition of binding of [125I]CCK-8 to Cholecystokinin receptor in... | 2754692 |
| Cholecystokinin receptor type A | IC50 | = | 7.5 | nM | 8.12 | Ability to inhibit the binding of [125I]CCK-8 to Cholecystokinin type A receptor... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(00)80683-6 | Gastrin/cholecystokinin type B receptor | 2 |
| 2754692 | 10.1021/jm00128a004 | Cholecystokinin receptor | 1 |
| - | 10.1016/S0960-894X(00)80683-6 | Cholecystokinin receptor type A | 1 |
Data from ChEMBL 36 via Core Engine