Compound Detail
CHEMBL4206764
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Basic Information
| ChEMBL ID | CHEMBL4206764 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GYTXWTOJZQGKDP-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
415.5
MW (Da)
0.54
ALogP
10
HBA
4
HBD
178.2
PSA (Ų)
0.40
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 3 meas. best 7.38
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Urokinase-type plasminogen activator CHEMBL3286 | Ki | 7.38 | 7.38 | 42.0 | 1 |
| Urokinase-type plasminogen activator CHEMBL1075311 | Ki | 5.48 | 5.48 | 3293.0 | 1 |
| Unchecked CHEMBL612545 | Ki | 5.16 | 5.16 | 6880.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Urokinase-type plasminogen activator | Ki | = | 42.0 | nM | 7.38 | Inhibition of human kidney uPA using Z-Gly-Gly-Arg-AMC as substrate measured ove... | 30130401 |
| Urokinase-type plasminogen activator | Ki | = | 3293.0 | nM | 5.48 | Inhibition of mouse uPA using Z-Gly-Gly-Arg-AMC as substrate measured for 15 min... | 34898192 |
| Unchecked | Ki | = | 6880.0 | nM | 5.16 | Inhibition of human uPA H99Y mutant using pyroGlu-Gly-Arg-pNA as substrate by ab... | 34898192 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 34898192 | 10.1021/acs.jmedchem.1c01423 | Unchecked | 3 |
| 30130401 | 10.1021/acs.jmedchem.8b00838 | Urokinase-type plasminogen activator | 1 |
| 34898192 | 10.1021/acs.jmedchem.1c01423 | Urokinase-type plasminogen activator | 1 |
Data from ChEMBL 36 via Core Engine