Compound Detail
CHEMBL4756432
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Basic Information
| ChEMBL ID | CHEMBL4756432 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NSDNBVJPZFOCFP-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
314.5
MW (Da)
3.09
ALogP
3
HBA
0
HBD
15.7
PSA (Ų)
0.79
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.8
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histamine H3 receptor CHEMBL264 | Ki | 7.8 | 7.8 | 15.8 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histamine H3 receptor | Ki | = | 15.85 | nM | 7.8 | Displacement of [3H]-Histamine from human histamine 3 receptor transfected in HE... | 33333448 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 33333448 | 10.1016/j.bmc.2020.115924 | Histamine H3 receptor | 3 |
| 33333448 | 10.1016/j.bmc.2020.115924 | Histamine H4 receptor | 1 |
Data from ChEMBL 36 via Core Engine