Compound Detail
CHEMBL1729988
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Basic Information
| ChEMBL ID | CHEMBL1729988 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UTNPMTKEFGJYRK-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
262.7
MW (Da)
3.46
ALogP
3
HBA
1
HBD
55.1
PSA (Ų)
0.92
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 5.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Signal transducer and activator of transcription 1-alpha/beta CHEMBL6101 | EC50 | 5.52 | 5.52 | 3047.0 | 1 |
| Signal transducer and activator of transcription 3 CHEMBL4026 | EC50 | 5.22 | 5.22 | 6080.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Signal transducer and activator of transcription 1-alpha/beta | EC50 | = | 3047.0 | nM | 5.52 | PUBCHEM_BIOASSAY: Late stage results from the probe development effort to identi... | - |
| Signal transducer and activator of transcription 3 | EC50 | = | 6080.0 | nM | 5.22 | PUBCHEM_BIOASSAY: Late stage results from the probe development effort to identi... | - |
Data from ChEMBL 36 via Core Engine