Compound Detail
CHEMBL1364583
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Basic Information
| ChEMBL ID | CHEMBL1364583 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ILNZPCHQXNINAG-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
425.5
MW (Da)
2.94
ALogP
8
HBA
1
HBD
95.3
PSA (Ų)
0.40
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 5.59
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosine-protein phosphatase non-receptor type 7 CHEMBL2219 | IC50 | 5.59 | 5.59 | 2540.0 | 1 |
| Major prion protein CHEMBL4869 | IC50 | 5.33 | 5.33 | 4664.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosine-protein phosphatase non-receptor type 7 | IC50 | = | 2540.0 | nM | 5.59 | PUBCHEM_BIOASSAY: HTS Discovery of Chemical Inhibitors of HePTP, a Leukemia Targ... | - |
| Major prion protein | IC50 | = | 4664.0 | nM | 5.33 | PubChem BioAssay. TRFRET-based cell-based high throughput dose response assay to... | - |
Data from ChEMBL 36 via Core Engine