Compound Detail
CHEMBL73162
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Basic Information
| ChEMBL ID | CHEMBL73162 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ITEIWWXXJGTIIN-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
400.4
MW (Da)
3.70
ALogP
4
HBA
6
HBD
149.2
PSA (Ų)
0.17
QED
1
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.92
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Coagulation factor VII/tissue factor CHEMBL2095194 | Ki | 7.92 | 7.92 | 12.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Coagulation factor VII/tissue factor | Ki | = | 12.0 | nM | 7.92 | Binding affinity for factor VIIa/TF | 11527709 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11527709 | 10.1016/s0960-894x(01)00420-6 | Coagulation factor VII/tissue factor | 1 |
| 11527709 | 10.1016/s0960-894x(01)00420-6 | Coagulation factor X | 1 |
| 11527709 | 10.1016/s0960-894x(01)00420-6 | Prothrombin | 1 |
| 11527709 | 10.1016/s0960-894x(01)00420-6 | Plasminogen | 1 |
| 11527709 | 10.1016/s0960-894x(01)00420-6 | Serine protease 1 | 1 |
| 11527709 | 10.1016/s0960-894x(01)00420-6 | Urokinase-type plasminogen activator | 1 |
Data from ChEMBL 36 via Core Engine