Compound Detail
CHEMBL3289421
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Basic Information
| ChEMBL ID | CHEMBL3289421 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QTAFSEJFKCZGEE-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
1
PK Parameters
5
Publications
0
Known Names
Molecular Properties
386.5
MW (Da)
2.83
ALogP
5
HBA
1
HBD
66.7
PSA (Ų)
0.55
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 7.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 7.1 | 7.1 | 80.0 | 1 |
| DNA-directed RNA polymerase I subunit RPA1 CHEMBL3286067 | IC50 | 7.05 | 6.74 | 90.0 | 2 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| T1/2 | 0.55 | hr | Homo sapiens |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 80.0 | nM | 7.1 | Inhibition of RNA polymerase-1 in human U2OS cells assessed as decrease in nucle... | 24847734 |
| DNA-directed RNA polymerase I subunit RPA1 | IC50 | = | 90.0 | nM | 7.05 | Induction of RNA polymerase-1 RPA194 subunit degradation in human U2OS cells aft... | 24847734 |
| DNA-directed RNA polymerase I subunit RPA1 | IC50 | = | 370.0 | nM | 6.43 | Inhibition of RNA polymerase 1 in human A-375 assessed as RPA194 degradation mea... | 35450366 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24847734 | 10.1021/jm5004842 | DNA-directed RNA polymerase I subunit RPA1 | 1 |
| 24847734 | 10.1021/jm5004842 | Unchecked | 1 |
| 24847734 | 10.1021/jm5004842 | U2OS | 1 |
| 24847734 | 10.1021/jm5004842 | Liver microsome | 1 |
| 35450366 | 10.1021/acsmedchemlett.1c00660 | DNA-directed RNA polymerase I subunit RPA1 | 1 |
Data from ChEMBL 36 via Core Engine