Compound Detail
CHEMBL569682
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Basic Information
| ChEMBL ID | CHEMBL569682 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZXEOPBBDKXMHKM-UHFFFAOYSA-N |
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
541.4
MW (Da)
5.30
ALogP
5
HBA
2
HBD
70.2
PSA (Ų)
0.32
QED
2
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 5.38
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| TCF4/beta-catenin CHEMBL3038511 | IC50 | 5.38 | 5.275 | 4192.0 | 2 |
| NON-PROTEIN TARGET CHEMBL3879801 | IC50 | 5.38 | 5.275 | 4192.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| NON-PROTEIN TARGET | IC50 | = | 4192.0 | nM | 5.38 | Growth inhibition of human Tcf 33.13 cells transiently transfected with pGL3-Tcf... | 20025292 |
| TCF4/beta-catenin | IC50 | = | 4192.0 | nM | 5.38 | Inhibition of TCF-4/beta catenin in human Tcf33.13 cells expressing Tcf-4/SV40 b... | - |
| NON-PROTEIN TARGET | IC50 | = | 6814.0 | nM | 5.17 | Growth inhibition of human Tcf22C11 cells transiently transfected with pGL3-Tcf4... | 20025292 |
| TCF4/beta-catenin | IC50 | = | 6815.0 | nM | 5.17 | Inhibition of TCF-4/beta catenin in human Tcf22C11 cells expressing Tcf-4/SV40 b... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20025292 | 10.1021/jm901370m | NON-PROTEIN TARGET | 3 |
| 20025292 | 10.1021/jm901370m | No relevant target | 1 |
| 20025292 | 10.1021/jm901370m | ADMET | 1 |
Data from ChEMBL 36 via Core Engine