Compound Detail
CHEMBL24827
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Basic Information
| ChEMBL ID | CHEMBL24827 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CIOZQXIDZUKYKM-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
444.0
MW (Da)
3.72
ALogP
4
HBA
3
HBD
105.3
PSA (Ų)
0.35
QED
0
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 3 meas. best 5.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Prothrombin CHEMBL204 | Ki | 5.82 | 5.82 | 1500.0 | 1 |
| Serine protease 1 CHEMBL3769 | Ki | 5.77 | 5.77 | 1700.0 | 1 |
| Plasminogen CHEMBL1801 | Ki | 4.47 | 4.47 | 34000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Prothrombin | Ki | = | 1500.0 | nM | 5.82 | Tested for the Inhibition of the catalytic activity of human Thrombin at 25 degr... | - |
| Serine protease 1 | Ki | = | 1700.0 | nM | 5.77 | Tested for the Inhibition of the catalytic activity of bovine trypsin at 25 degr... | - |
| Plasminogen | Ki | = | 34000.0 | nM | 4.47 | Tested for the Inhibition of the catalytic activity of human plasmin at 25 degre... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(97)00210-2 | Prothrombin | 1 |
| - | 10.1016/S0960-894X(97)00210-2 | Serine protease 1 | 1 |
| - | 10.1016/S0960-894X(97)00210-2 | Plasminogen | 1 |
Data from ChEMBL 36 via Core Engine