Compound Detail
CHEMBL608479
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Basic Information
| ChEMBL ID | CHEMBL608479 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CKDZRXBDXPNQDD-BYBOBHAWSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
260.2
MW (Da)
-2.59
ALogP
6
HBA
4
HBD
119.3
PSA (Ų)
0.43
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 5.05
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cytidine deaminase CHEMBL4502 | Ki | 5.05 | 5.05 | 9000.0 | 1 |
| Cytidine deaminase CHEMBL2110 | Ki | 4.7 | 4.7 | 20000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cytidine deaminase | Ki | = | 9000.0 | nM | 5.05 | Cytidine Deaminase Inhibition in human liver | 7401098 |
| Cytidine deaminase | Ki | = | 20000.0 | nM | 4.7 | Cytidine Deaminase Inhibition in mouse Kidney | 7401098 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7401098 | 10.1021/jm00181a001 | Cytidine deaminase | 2 |
Data from ChEMBL 36 via Core Engine