Compound Detail
CHEMBL34062
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Basic Information
| ChEMBL ID | CHEMBL34062 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RCJFINNFYUNFGH-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
405.3
MW (Da)
4.18
ALogP
6
HBA
2
HBD
96.3
PSA (Ų)
0.66
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 10.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Dipeptidyl peptidase 4 CHEMBL284 | IC50 | 10.0 | 10.0 | 0.1 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Dipeptidyl peptidase 4 | IC50 | = | 0.1 | nM | 10.0 | Inhibitory activity against Dipeptidylpeptidase IV mediated cleavage of Ala-Pro-... | 15006388 |
| Dipeptidyl peptidase 4 | IC50 | = | 0.1 | nM | 10.0 | Inhibition of DPP4 | 21996517 |
| Dipeptidyl peptidase 4 | IC50 | = | 0.1 | nM | 10.0 | Inhibition of dipeptidyl peptidase 4 (unknown origin) | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15006388 | 10.1016/j.bmcl.2004.01.019 | Dipeptidyl peptidase 4 | 1 |
| 21996517 | 10.1016/j.bmcl.2011.09.093 | Dipeptidyl peptidase 4 | 1 |
| - | 10.1007/s00044-012-0455-6 | Dipeptidyl peptidase 4 | 1 |
Data from ChEMBL 36 via Core Engine