Compound Detail
CHEMBL605430
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
CCC[C@@H](OP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]1OC(n2c(SCC)nc3c(N)ncnc32)[C@H](O)[C@@H]1O)[C@H]1OC(n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O
Basic Information
| ChEMBL ID | CHEMBL605430 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BXKSTLGWXAMGML-CCWYCDDBSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
1018.6
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 4.28
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Adenylate kinase 2, mitochondrial CHEMBL2376 | Ki | 4.28 | 4.24 | 52000.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Adenylate kinase 2, mitochondrial | Ki | = | 52000.0 | nM | 4.28 | Inhibitory activity against rat adenylate kinase II was determined in the presen... | 6292418 |
| Adenylate kinase 2, mitochondrial | Ki | = | 63000.0 | nM | 4.2 | Inhibitory activity against rat adenylate kinase II was determined in the presen... | 6292418 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 6292418 | 10.1021/jm00352a016 | Unchecked | 5 |
| 6292418 | 10.1021/jm00352a016 | Adenylate kinase 2, mitochondrial | 2 |
Data from ChEMBL 36 via Core Engine