Compound Detail
CHEMBL88599
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Basic Information
| ChEMBL ID | CHEMBL88599 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YFYUEDBDPOAUSC-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
355.4
MW (Da)
3.02
ALogP
7
HBA
1
HBD
90.4
PSA (Ų)
0.71
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.26
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Methionine aminopeptidase 1 CHEMBL2526 | IC50 | 6.26 | 6.26 | 550.0 | 1 |
| Methionine aminopeptidase CHEMBL3423 | IC50 | 5.77 | 5.77 | 1700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Methionine aminopeptidase 1 | IC50 | = | 550.0 | nM | 6.26 | Inhibitory activity against type I methionine aminopeptidase from Saccharomyces ... | 12801227 |
| Methionine aminopeptidase | IC50 | = | 1700.0 | nM | 5.77 | Inhibitory activity against Methionine aminopeptidase 1 from Escherichia coli | 12801227 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12801227 | 10.1021/jm0300532 | Methionine aminopeptidase | 1 |
| 12801227 | 10.1021/jm0300532 | Methionine aminopeptidase 1 | 1 |
| 12801227 | 10.1021/jm0300532 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine