Compound Detail
CHEMBL373000
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL373000 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CGHGXIYPAJLYNP-UHFFFAOYSA-N |
2
Targets
3
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
346.9
MW (Da)
3.35
ALogP
3
HBA
2
HBD
61.0
PSA (Ų)
0.84
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 9.7
Kd 1 meas. best 9.8
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histamine H3 receptor CHEMBL5076 | Kd | 9.8 | 9.8 | 0.2 | 1 |
| Histamine H3 receptor CHEMBL5076 | Ki | 9.7 | 9.7 | 0.2 | 1 |
| Histamine H3 receptor CHEMBL264 | Ki | 9.4 | 9.4 | 0.4 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histamine H3 receptor | Kd | = | 0.1585 | nM | 9.8 | Antagonist potency against histamine H3 receptor in an electrically stimulated g... | 16246552 |
| Histamine H3 receptor | Ki | = | 0.2 | nM | 9.7 | Displacement of [3H]N-alpha-methylhistamine from histamine H3 receptor in guinea... | 16246552 |
| Histamine H3 receptor | Ki | = | 0.4 | nM | 9.4 | Displacement of [3H]N-alpha-methylhistamine from histamine H3 receptor in human ... | 16246552 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16246552 | 10.1016/j.bmcl.2005.09.076 | Histamine H3 receptor | 3 |
Data from ChEMBL 36 via Core Engine