Compound Detail
CHEMBL3753746
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Basic Information
| ChEMBL ID | CHEMBL3753746 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XGHPFIDDLHHTKE-ORCOQGSOSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
14
Publications
0
Known Names
Molecular Properties
341.2
MW (Da)
-0.04
ALogP
7
HBA
4
HBD
117.4
PSA (Ų)
0.61
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.89
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| S-adenosylhomocysteine hydrolase-like protein 1 CHEMBL3751646 | IC50 | 7.89 | 7.89 | 13.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| S-adenosylhomocysteine hydrolase-like protein 1 | IC50 | = | 13.0 | nM | 7.89 | Inhibition of S-adenosylhomocysteine hydrolase (unknown origin) | 26750250 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26750250 | 10.1016/j.bmcl.2015.12.061 | Ebolavirus | 1 |
| 26750250 | 10.1016/j.bmcl.2015.12.061 | Vero | 1 |
| 26750250 | 10.1016/j.bmcl.2015.12.061 | Unchecked | 1 |
| 26750250 | 10.1016/j.bmcl.2015.12.061 | Human betaherpesvirus 5 | 1 |
| 26750250 | 10.1016/j.bmcl.2015.12.061 | Measles morbillivirus | 1 |
| 26750250 | 10.1016/j.bmcl.2015.12.061 | S-adenosylhomocysteine hydrolase-like protein 1 | 1 |
| 26750250 | 10.1016/j.bmcl.2015.12.061 | Rift Valley fever virus | 1 |
| 26750250 | 10.1016/j.bmcl.2015.12.061 | Tacaribe virus | 1 |
| 26750250 | 10.1016/j.bmcl.2015.12.061 | Dengue virus | 1 |
| 26750250 | 10.1016/j.bmcl.2015.12.061 | Yellow fever virus | 1 |
| 26750250 | 10.1016/j.bmcl.2015.12.061 | Hepatitis C virus | 1 |
| 26750250 | 10.1016/j.bmcl.2015.12.061 | NON-PROTEIN TARGET | 1 |
| 26750250 | 10.1016/j.bmcl.2015.12.061 | Japanese encephalitis virus | 1 |
| 26750250 | 10.1016/j.bmcl.2015.12.061 | Nipah virus | 1 |
Data from ChEMBL 36 via Core Engine