Compound Detail
CHEMBL1371777
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Basic Information
| ChEMBL ID | CHEMBL1371777 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HZYOUKHXCBYDBT-UHFFFAOYSA-N |
7
Targets
10
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
369.8
MW (Da)
5.34
ALogP
6
HBA
0
HBD
65.0
PSA (Ų)
0.44
QED
1
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 8 meas. best 6.48
EC50 2 meas. best 4.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosine-protein phosphatase non-receptor type 7 CHEMBL2219 | IC50 | 6.48 | 5.73 | 329.0 | 2 |
| Ephrin type-A receptor 4 CHEMBL1293259 | IC50 | 5.61 | 5.61 | 2460.0 | 1 |
| Phospholipase A2 CHEMBL4426 | IC50 | 5.12 | 5.12 | 7530.0 | 1 |
| Cysteine protease ATG4B CHEMBL1741221 | IC50 | 4.94 | 4.94 | 11400.0 | 1 |
| Unchecked CHEMBL612545 | EC50 | 4.82 | 4.815 | 15000.0 | 2 |
| Dual specificity protein phosphatase 3 CHEMBL2635 | IC50 | 4.71 | 4.71 | 19700.0 | 1 |
| Dual specificity protein phosphatase 6 CHEMBL5511 | IC50 | 4.62 | 4.565 | 24200.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine