Compound Detail
CHEMBL275368
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Basic Information
| ChEMBL ID | CHEMBL275368 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YKDGUSPLRQPKMU-AWEZNQCLSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
427.5
MW (Da)
2.20
ALogP
6
HBA
2
HBD
108.0
PSA (Ų)
0.51
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 7.75
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Coagulation factor X CHEMBL244 | Ki | 7.75 | 7.75 | 18.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Coagulation factor X | Ki | = | 18.0 | nM | 7.75 | Binding affinity on Coagulation factor X | 10966741 |
| Coagulation factor X | Ki | = | 18.0 | nM | 7.75 | Inhibition of factor 10a | 20503967 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10966741 | 10.1021/jm000940u | Coagulation factor X | 1 |
| 10966741 | 10.1021/jm000940u | Trypsin II | 1 |
| 10966741 | 10.1021/jm000940u | Prothrombin | 1 |
| 10843210 | 10.1016/s0960-894x(00)00151-7 | Coagulation factor X | 1 |
| 20503967 | 10.1021/jm100146h | Coagulation factor X | 1 |
Data from ChEMBL 36 via Core Engine