Compound Detail
CHEMBL160057
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Basic Information
| ChEMBL ID | CHEMBL160057 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HKOLFXDCHCCSCT-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
310.4
MW (Da)
1.14
ALogP
5
HBA
1
HBD
66.7
PSA (Ų)
0.73
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 5.8
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| L1210 CHEMBL386 | IC50 | 5.8 | 5.8 | 1600.0 | 1 |
| DNA-directed RNA polymerase I subunit RPA1 CHEMBL3286067 | IC50 | 5.66 | 5.66 | 2170.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 5.5 | 5.5 | 3170.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| L1210 | IC50 | = | 1600.0 | nM | 5.8 | Concentration required to inhibit growth of murine leukemia (L1210) cells in cul... | 3351846 |
| DNA-directed RNA polymerase I subunit RPA1 | IC50 | = | 2170.0 | nM | 5.66 | Induction of RNA polymerase-1 RPA194 subunit degradation in human U2OS cells aft... | 24847734 |
| Unchecked | IC50 | = | 3170.0 | nM | 5.5 | Inhibition of RNA polymerase-1 in human U2OS cells assessed as decrease in nucle... | 24847734 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24847734 | 10.1021/jm5004842 | Unchecked | 3 |
| 3351846 | 10.1021/jm00399a003 | Calf thymus DNA | 2 |
| 3351846 | 10.1021/jm00399a003 | P388 | 2 |
| 24847734 | 10.1021/jm5004842 | DNA-directed RNA polymerase I subunit RPA1 | 2 |
| 3351846 | 10.1021/jm00399a003 | L1210 | 1 |
| 24847734 | 10.1021/jm5004842 | U2OS | 1 |
Data from ChEMBL 36 via Core Engine