Compound Detail
CHEMBL151999
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Basic Information
| ChEMBL ID | CHEMBL151999 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YYDIYVZHDUOXFZ-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
395.4
MW (Da)
5.83
ALogP
2
HBA
0
HBD
20.3
PSA (Ų)
0.28
QED
1
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.54
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Aminopeptidase N CHEMBL1907 | IC50 | 4.54 | 4.54 | 28800.0 | 1 |
| Dipeptidyl peptidase 4 CHEMBL284 | IC50 | 4.52 | 4.52 | 30400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Aminopeptidase N | IC50 | = | 28800.0 | nM | 4.54 | Inhibitory activity against aminopeptidase N (APN) in human acute lymphoblastic ... | 10098663 |
| Dipeptidyl peptidase 4 | IC50 | = | 30400.0 | nM | 4.52 | Inhibitory activity against Dipeptidylpeptidase IV (DPP IV) in human acute lymph... | 10098663 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10098663 | 10.1016/s0960-894x(99)00034-7 | Dipeptidyl peptidase 4 | 2 |
| 10098663 | 10.1016/s0960-894x(99)00034-7 | Aminopeptidase N | 2 |
| 10098663 | 10.1016/s0960-894x(99)00034-7 | NON-PROTEIN TARGET | 2 |
Data from ChEMBL 36 via Core Engine