Compound Detail
CHEMBL5285935
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Basic Information
| ChEMBL ID | CHEMBL5285935 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OXVNWUDHLNBZRB-GLTNYXDESA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
261.3
MW (Da)
-0.50
ALogP
7
HBA
3
HBD
110.1
PSA (Ų)
0.67
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 4.24
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sodium/nucleoside cotransporter 1 CHEMBL5551 | IC50 | 4.24 | 4.24 | 57000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sodium/nucleoside cotransporter 1 | IC50 | = | 57000.0 | nM | 4.24 | 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