Compound Detail
CHEMBL609353
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Basic Information
| ChEMBL ID | CHEMBL609353 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YQLJSFYLQCBEKY-TXDDJGQJSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
287.2
MW (Da)
-0.71
ALogP
8
HBA
3
HBD
119.3
PSA (Ų)
0.67
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 3 meas. best 5.01
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Adenosylhomocysteinase CHEMBL3118 | Ki | 5.01 | 5.01 | 9700.0 | 2 |
| Adenosylhomocysteinase CHEMBL2389 | Ki | 5.0 | 5.0 | 10000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Adenosylhomocysteinase | Ki | = | 9700.0 | nM | 5.01 | Competitive inhibitory activity against rat liver S-adenosyl-L-homocysteine hydr... | 1995889 |
| Adenosylhomocysteinase | Ki | = | 9700.0 | nM | 5.01 | Activity determined in rat liver S-adenosyl-L-homocysteine hydrolase and express... | 1995889 |
| Adenosylhomocysteinase | Ki | = | 10000.0 | nM | 5.0 | Activity determined in mouse liver S-adenosyl-L-homocysteine hydrolase and expre... | 1995889 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 1995889 | 10.1021/jm00106a028 | Adenosylhomocysteinase | 5 |
| 1995889 | 10.1021/jm00106a028 | Moloney murine leukemia virus | 1 |
Data from ChEMBL 36 via Core Engine