Compound Detail
CHEMBL6014809
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Basic Information
| ChEMBL ID | CHEMBL6014809 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MMZVCOZOFNZWBM-CGCSKFHYSA-N |
5
Targets
5
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
250.3
MW (Da)
2.04
ALogP
2
HBA
1
HBD
46.3
PSA (Ų)
0.89
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 5 meas. best 8.33
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Dipeptidyl peptidase 9 CHEMBL4793 | IC50 | 8.33 | 8.33 | 4.7 | 1 |
| Dipeptidyl peptidase 8 CHEMBL4657 | IC50 | 8.29 | 8.29 | 5.1 | 1 |
| Dipeptidyl peptidase 8/9 CHEMBL3885564 | IC50 | 7.24 | 7.24 | 58.0 | 1 |
| Dipeptidyl peptidase 4 CHEMBL284 | IC50 | 5.1 | 5.1 | 7900.0 | 1 |
| Dipeptidyl peptidase 2 CHEMBL3976 | IC50 | 4.52 | 4.52 | 30000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Dipeptidyl peptidase 9 | IC50 | = | 4.7 | nM | 8.33 | EnPlex (purified enzyme activity assay): This assay is described in Bachovchin e... | - |
| Dipeptidyl peptidase 8 | IC50 | = | 5.1 | nM | 8.29 | EnPlex (purified enzyme activity assay): This assay is described in Bachovchin e... | - |
| Dipeptidyl peptidase 8/9 | IC50 | = | 58.0 | nM | 7.24 | EnPlex (purified enzyme activity assay): This assay is described in Bachovchin e... | - |
| Dipeptidyl peptidase 4 | IC50 | = | 7900.0 | nM | 5.1 | EnPlex (purified enzyme activity assay): This assay is described in Bachovchin e... | - |
| Dipeptidyl peptidase 2 | IC50 | = | 30000.0 | nM | 4.52 | EnPlex (purified enzyme activity assay): This assay is described in Bachovchin e... | - |
Data from ChEMBL 36 via Core Engine