Compound Detail
CHEMBL281476
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Basic Information
| ChEMBL ID | CHEMBL281476 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ILMNSCQOSGKTNZ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
265.2
MW (Da)
-1.32
ALogP
9
HBA
2
HBD
133.2
PSA (Ų)
0.61
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 8.48
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Adenosylhomocysteinase CHEMBL2664 | Ki | 8.48 | 8.48 | 3.3 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Adenosylhomocysteinase | Ki | = | 3.3 | nM | 8.48 | Compound was tested for inhibition of S-adenosyl homocysteine (SAH) hydrolase. | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/0960-894X(96)00234-X | Adenosylhomocysteinase | 1 |
| - | 10.1016/0960-894X(96)00234-X | Vero | 1 |
| - | 10.1016/0960-894X(96)00234-X | L929 | 1 |
Data from ChEMBL 36 via Core Engine