Compound Detail
CHEMBL298929
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Basic Information
| ChEMBL ID | CHEMBL298929 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BLMLCNVYXIXSSE-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
263.2
MW (Da)
1.89
ALogP
3
HBA
3
HBD
99.6
PSA (Ų)
0.76
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 5.08
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Uracil nucleotide/cysteinyl leukotriene receptor CHEMBL1075162 | IC50 | 5.08 | 5.08 | 8400.0 | 1 |
| Glutamate NMDA receptor CHEMBL1907608 | IC50 | 4.89 | 4.89 | 13000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Uracil nucleotide/cysteinyl leukotriene receptor | IC50 | = | 8400.0 | nM | 5.08 | Antagonist activity at human GPR17 expressed in human 1321N1 cells assessed as i... | 30048589 |
| Glutamate NMDA receptor | IC50 | = | 13000.0 | nM | 4.89 | Ability to compete with [3H]glycine for strychnine-insensitive binding sites on ... | 1534125 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 30048589 | 10.1021/acs.jmedchem.7b01768 | Uracil nucleotide/cysteinyl leukotriene receptor | 3 |
| 1534125 | 10.1021/jm00088a014 | Glutamate NMDA receptor | 2 |
| 1534125 | 10.1021/jm00088a014 | NON-PROTEIN TARGET | 1 |
Data from ChEMBL 36 via Core Engine