Compound Detail
CHEMBL432800
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Basic Information
| ChEMBL ID | CHEMBL432800 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SUYDJIHTAHBJRR-UHFFFAOYSA-N |
1
Targets
4
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
387.4
MW (Da)
7.14
ALogP
2
HBA
0
HBD
16.1
PSA (Ų)
0.45
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 3 meas. best 9.05
IC50 1 meas. best 7.77
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Corticotropin-releasing factor receptor 1 CHEMBL1800 | Ki | 9.05 | 9.05 | 0.9 | 3 |
| Corticotropin-releasing factor receptor 1 CHEMBL1800 | IC50 | 7.77 | 7.77 | 17.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Corticotropin-releasing factor receptor 1 | Ki | = | 0.9 | nM | 9.05 | Binding affinity towards cloned human CRF1 receptor expressed in CHO cells using... | 12951129 |
| Corticotropin-releasing factor receptor 1 | Ki | = | 0.9 | nM | 9.05 | Displacement of [125I]sauvagine from CRF1 receptor expressed in human IMR32 cell... | 18180159 |
| Corticotropin-releasing factor receptor 1 | Ki | = | 0.9 | nM | 9.05 | Antagonist activity at human CRF-1 receptor | 21618986 |
| Corticotropin-releasing factor receptor 1 | IC50 | = | 17.0 | nM | 7.77 | Inhibition of Corticotropin releasing factor receptor 1-stimulated cAMP producti... | 12951129 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12951129 | 10.1016/s0960-894x(03)00684-x | Corticotropin-releasing factor receptor 1 | 2 |
| 18180159 | 10.1016/j.bmcl.2007.12.050 | Corticotropin-releasing factor receptor 1 | 1 |
| 21618986 | 10.1021/jm200365y | Corticotropin-releasing factor receptor 1 | 1 |
Data from ChEMBL 36 via Core Engine