Compound Detail
CHEMBL281590
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Basic Information
| ChEMBL ID | CHEMBL281590 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GORRKRHEHKVTEB-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
243.3
MW (Da)
0.96
ALogP
5
HBA
1
HBD
58.3
PSA (Ų)
0.81
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 7.5
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histamine H4 receptor CHEMBL3759 | Ki | 7.5 | 7.425 | 32.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histamine H4 receptor | Ki | = | 32.0 | nM | 7.5 | Displacement of [3H]histamine from human H4 receptor expressed in HEK cell membr... | 22153663 |
| Histamine H4 receptor | Ki | = | 44.67 | nM | 7.35 | Displacement of [3H]histamine from human histamine H4 receptor expressed in HEK ... | 23558237 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10890155 | 10.1016/s0960-894x(00)00227-4 | Mus musculus | 1 |
| 22153663 | 10.1016/j.bmcl.2011.10.104 | Histamine H4 receptor | 1 |
| 23558237 | 10.1016/j.bmcl.2013.02.091 | Histamine H4 receptor | 1 |
Data from ChEMBL 36 via Core Engine