Compound Detail
CHEMBL5874480
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Basic Information
| ChEMBL ID | CHEMBL5874480 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HJMXEGGWHDPLCR-LBPRGKRZSA-N |
4
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
236.3
MW (Da)
1.65
ALogP
2
HBA
1
HBD
46.3
PSA (Ų)
0.85
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 7.41
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Dipeptidyl peptidase 8 CHEMBL4657 | IC50 | 7.41 | 7.41 | 39.0 | 1 |
| Dipeptidyl peptidase 9 CHEMBL4793 | IC50 | 6.95 | 6.95 | 112.0 | 1 |
| Dipeptidyl peptidase 4 CHEMBL284 | IC50 | 4.69 | 4.69 | 20270.0 | 1 |
| Dipeptidyl peptidase 2 CHEMBL3976 | IC50 | 4.35 | 4.35 | 44850.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Dipeptidyl peptidase 8 | IC50 | = | 39.0 | nM | 7.41 | EnPlex (purified enzyme activity assay): This assay is described in Bachovchin e... | - |
| Dipeptidyl peptidase 9 | IC50 | = | 112.0 | nM | 6.95 | EnPlex (purified enzyme activity assay): This assay is described in Bachovchin e... | - |
| Dipeptidyl peptidase 4 | IC50 | = | 20270.0 | nM | 4.69 | EnPlex (purified enzyme activity assay): This assay is described in Bachovchin e... | - |
| Dipeptidyl peptidase 2 | IC50 | = | 44850.0 | nM | 4.35 | EnPlex (purified enzyme activity assay): This assay is described in Bachovchin e... | - |
Data from ChEMBL 36 via Core Engine