Compound Detail
CHEMBL3741100
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Basic Information
| ChEMBL ID | CHEMBL3741100 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PIDVUWFEEVNNIO-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
8
Publications
0
Known Names
Molecular Properties
449.6
MW (Da)
1.23
ALogP
7
HBA
5
HBD
126.8
PSA (Ų)
0.26
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.39
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Urokinase-type plasminogen activator CHEMBL3286 | IC50 | 6.39 | 6.39 | 404.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Urokinase-type plasminogen activator | IC50 | = | 404.0 | nM | 6.39 | Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para... | 26575094 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26575094 | 10.1021/acs.jmedchem.5b01171 | Urokinase-type plasminogen activator | 4 |
| 26575094 | 10.1021/acs.jmedchem.5b01171 | Coagulation factor VII | 1 |
| 26575094 | 10.1021/acs.jmedchem.5b01171 | Prothrombin | 1 |
| 26575094 | 10.1021/acs.jmedchem.5b01171 | Tissue-type plasminogen activator | 1 |
| 26575094 | 10.1021/acs.jmedchem.5b01171 | Coagulation factor X | 1 |
| 26575094 | 10.1021/acs.jmedchem.5b01171 | Plasminogen | 1 |
| 26575094 | 10.1021/acs.jmedchem.5b01171 | Plasma kallikrein | 1 |
| 26575094 | 10.1021/acs.jmedchem.5b01171 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine