Compound Detail
CHEMBL1318943
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Basic Information
| ChEMBL ID | CHEMBL1318943 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QEKYDTGXFOVMRB-UHFFFAOYSA-N |
7
Targets
12
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
293.4
MW (Da)
2.71
ALogP
3
HBA
1
HBD
50.5
PSA (Ų)
0.68
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 9 meas. best 6.12
IC50 3 meas. best 6.2
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 6.2 | 6.2 | 637.0 | 1 |
| ATP-dependent molecular chaperone HSP82 CHEMBL1293251 | EC50 | 6.12 | 6.12 | 750.0 | 1 |
| Unchecked CHEMBL612545 | EC50 | 6.03 | 5.8425 | 942.0 | 4 |
| Protein RecA CHEMBL1741171 | EC50 | 5.36 | 5.36 | 4370.0 | 1 |
| Tyrosine-protein kinase JAK2 CHEMBL2971 | IC50 | 5.28 | 5.28 | 5197.0 | 1 |
| Peroxisome proliferator-activated receptor gamma/Nuclear receptor coactivator 2 CHEMBL2095163 | EC50 | 4.84 | 4.84 | 14390.0 | 1 |
| Peroxisome proliferator-activated receptor gamma/Nuclear receptor coactivator 1 CHEMBL2095162 | EC50 | 4.83 | 4.83 | 14900.0 | 1 |
| Mannose-6-phosphate isomerase CHEMBL2758 | IC50 | 4.32 | 4.32 | 48238.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine