Compound Detail
CHEMBL2376802
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Basic Information
| ChEMBL ID | CHEMBL2376802 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FKEZNZQUWVVTHQ-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
255.3
MW (Da)
-0.11
ALogP
7
HBA
2
HBD
103.8
PSA (Ų)
0.77
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 7.27
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histamine H4 receptor CHEMBL3759 | Ki | 7.27 | 7.27 | 53.7 | 1 |
| Histamine H3 receptor CHEMBL264 | Ki | 5.02 | 5.02 | 9549.9 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histamine H4 receptor | Ki | = | 53.7 | nM | 7.27 | Displacement of [3H]histamine from human histamine H4 receptor expressed in HEK ... | 23558237 |
| Histamine H3 receptor | Ki | = | 9549.93 | nM | 5.02 | Displacement of [3H]histamine from human histamine H3 receptor expressed in HEK ... | 23558237 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23558237 | 10.1016/j.bmcl.2013.02.091 | Voltage-gated inwardly rectifying potassium channel KCNH2 | 1 |
| 23558237 | 10.1016/j.bmcl.2013.02.091 | Unchecked | 1 |
| 23558237 | 10.1016/j.bmcl.2013.02.091 | Histamine H3 receptor | 1 |
| 23558237 | 10.1016/j.bmcl.2013.02.091 | Histamine H4 receptor | 1 |
Data from ChEMBL 36 via Core Engine