Compound Detail
CHEMBL65137
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Basic Information
| ChEMBL ID | CHEMBL65137 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HSJLIVRPUWALLP-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
384.8
MW (Da)
5.07
ALogP
5
HBA
2
HBD
71.5
PSA (Ų)
0.52
QED
1
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.19
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| DNA polymerase catalytic subunit CHEMBL4009 | IC50 | 5.19 | 5.19 | 6400.0 | 1 |
| DNA polymerase alpha catalytic subunit CHEMBL1828 | IC50 | 4.03 | 4.03 | 93000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| DNA polymerase catalytic subunit | IC50 | = | 6400.0 | nM | 5.19 | Inhibitory activity against Human Cytomegalovirus (HCMV) polymerase | 10999475 |
| DNA polymerase alpha catalytic subunit | IC50 | = | 93000.0 | nM | 4.03 | Compound was evaluated for the inhibitory activity against Human alpha polymeras... | 10999475 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10999475 | 10.1016/s0960-894x(00)00402-9 | DNA polymerase catalytic subunit | 1 |
| 10999475 | 10.1016/s0960-894x(00)00402-9 | DNA polymerase alpha catalytic subunit | 1 |
| 10999475 | 10.1016/s0960-894x(00)00402-9 | HFF | 1 |
Data from ChEMBL 36 via Core Engine