Compound Detail
CHEMBL1447505
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Basic Information
| ChEMBL ID | CHEMBL1447505 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DCCWNYJXGNAWRL-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
418.9
MW (Da)
4.55
ALogP
4
HBA
0
HBD
49.9
PSA (Ų)
0.67
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 4.97
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Zinc finger protein GLI1 CHEMBL5007 | IC50 | 4.97 | 4.97 | 10800.0 | 1 |
| Signal transducer and activator of transcription 3 CHEMBL4026 | IC50 | 4.78 | 4.78 | 16480.0 | 1 |
| Mitochondrial import inner membrane translocase subunit TIM10 CHEMBL1741194 | IC50 | 4.13 | 4.13 | 74100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Zinc finger protein GLI1 | IC50 | = | 10800.0 | nM | 4.97 | PubChem BioAssay. Dose response confirmation of uHTS antagonist hits from Gli-SU... | - |
| Signal transducer and activator of transcription 3 | IC50 | = | 16480.0 | nM | 4.78 | PUBCHEM_BIOASSAY: Dose response counterscreen for STAT1 inhibitors: cell-based h... | - |
| Mitochondrial import inner membrane translocase subunit TIM10 | IC50 | = | 74100.0 | nM | 4.13 | PUBCHEM_BIOASSAY: Dose Response confirmation of uHTS small molecule inhibitors o... | - |
Data from ChEMBL 36 via Core Engine