Compound Detail
CHEMBL312378
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL312378 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DQTMNMNOSWBIOY-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
412.4
MW (Da)
4.60
ALogP
5
HBA
2
HBD
84.5
PSA (Ų)
0.44
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 3 meas. best 6.19
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Coagulation factor X CHEMBL244 | Ki | 6.19 | 6.19 | 640.0 | 2 |
| Prothrombin CHEMBL204 | Ki | 4.66 | 4.66 | 22000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Coagulation factor X | Ki | = | 640.0 | nM | 6.19 | Inhibitory potency was measured against human coagulation factor X | 9733480 |
| Coagulation factor X | Ki | = | 640.0 | nM | 6.19 | Inhibitory constant against human coagulation factor Xa (fXa) | 12036356 |
| Prothrombin | Ki | = | 22000.0 | nM | 4.66 | Inhibitory potency was measured against human thrombin | 9733480 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9733480 | 10.1021/jm980280h | Coagulation factor X | 1 |
| 9733480 | 10.1021/jm980280h | Prothrombin | 1 |
| 12036356 | 10.1021/jm0200660 | Coagulation factor X | 1 |
Data from ChEMBL 36 via Core Engine