Compound Detail
CHEMBL3185613
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Basic Information
| ChEMBL ID | CHEMBL3185613 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QQMZBQRVJLKJLG-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
288.3
MW (Da)
2.71
ALogP
4
HBA
1
HBD
58.1
PSA (Ų)
0.92
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.76
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Protein Wnt-3a CHEMBL5617 | IC50 | 6.76 | 6.76 | 172.0 | 1 |
| Zinc finger protein GLI1 CHEMBL5007 | IC50 | 6.25 | 6.25 | 556.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Protein Wnt-3a | IC50 | = | 172.0 | nM | 6.76 | PubChem BioAssay. SAR analysis of small molecule antagonists of Gli-SUFU in a Wn... | - |
| Zinc finger protein GLI1 | IC50 | = | 556.0 | nM | 6.25 | PubChem BioAssay. SAR analysis of small molecule antagonists of Gli-SUFU in a lu... | - |
Data from ChEMBL 36 via Core Engine