Compound Detail
CHEMBL5270911
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Basic Information
| ChEMBL ID | CHEMBL5270911 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GJDYOCPKYJVOMS-MOEZTCPLSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
261.3
MW (Da)
-0.29
ALogP
7
HBA
3
HBD
110.1
PSA (Ų)
0.69
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sodium/nucleoside cotransporter 2 CHEMBL5780 | IC50 | 5.0 | 5.0 | 10000.0 | 1 |
| Sodium/nucleoside cotransporter 1 CHEMBL5551 | IC50 | 4.31 | 4.31 | 49000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sodium/nucleoside cotransporter 2 | IC50 | = | 10000.0 | nM | 5.0 | Inhibition of human CNT2 | 34825182 |
| Sodium/nucleoside cotransporter 1 | IC50 | = | 49000.0 | nM | 4.31 | Inhibition of human CNT1 | 34825182 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 34825182 | 10.1039/D1MD00167A | Equilibrative nucleoside transporter 1 | 1 |
| 34825182 | 10.1039/D1MD00167A | Sodium/nucleoside cotransporter 1 | 1 |
| 34825182 | 10.1039/D1MD00167A | Sodium/nucleoside cotransporter 2 | 1 |
Data from ChEMBL 36 via Core Engine