Compound Detail
CHEMBL4539240
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Basic Information
| ChEMBL ID | CHEMBL4539240 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZSABMQKZFXLPQV-UHFFFAOYSA-N |
2
Targets
4
Activities
2
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
542.4
MW (Da)
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas.
Ki 2 meas. best 8.34
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 8.34 | 8.34 | 4.6 | 1 |
| Urease subunit alpha/Urease subunit beta CHEMBL3885651 | Ki | 5.49 | 5.49 | 3259.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 4.62 | nM | 8.34 | Steady state inhibition of Sporosarcina pasteurii CCM 2056 urease using urea as ... | 27524377 |
| Urease subunit alpha/Urease subunit beta | Ki | = | 3259.0 | nM | 5.49 | Inhibition of recombinant Helicobacter pylori urease expressed in Escherichia co... | 27524377 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 27524377 | 10.1021/acs.jmedchem.6b00986 | Urease subunit alpha/Urease subunit beta | 6 |
| 27524377 | 10.1021/acs.jmedchem.6b00986 | Unchecked | 3 |
Data from ChEMBL 36 via Core Engine