Compound Detail
CHEMBL1378232
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Basic Information
| ChEMBL ID | CHEMBL1378232 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YJXZIXCBVKMSJR-UHFFFAOYSA-N |
3
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
297.4
MW (Da)
2.82
ALogP
3
HBA
1
HBD
47.6
PSA (Ų)
0.94
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 6.44
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 6.44 | 6.245 | 366.0 | 2 |
| Krueppel-like factor 5 CHEMBL1293249 | IC50 | 6.38 | 6.38 | 421.2 | 1 |
| Jurkat CHEMBL397 | IC50 | 6.19 | 6.19 | 640.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 366.0 | nM | 6.44 | PUBCHEM_BIOASSAY: Dose response confirmation of uHTS chemical inhibitors of both... | - |
| Krueppel-like factor 5 | IC50 | = | 421.16 | nM | 6.38 | PUBCHEM_BIOASSAY: Luminescence-based dose response cell-based high throughput sc... | - |
| Jurkat | IC50 | = | 640.0 | nM | 6.19 | PUBCHEM_BIOASSAY: Dose response confirmation of uHTS of chemical inhibitors of b... | - |
| Unchecked | IC50 | = | 900.0 | nM | 6.05 | PUBCHEM_BIOASSAY: Dose response counterscreen of uHTS chemical inhibitors of bot... | - |
Data from ChEMBL 36 via Core Engine