Compound Detail
CHEMBL4861004
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Basic Information
| ChEMBL ID | CHEMBL4861004 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SKXUMNZZYRTYRM-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
283.5
MW (Da)
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 6.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 6.7 | 5.56 | 200.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 200.0 | nM | 6.7 | Inhibition of bacterial Beta-lactamase KPC-2 (29 - 289) (unknown origin) express... | 33744439 |
| Unchecked | IC50 | = | 5660.0 | nM | 5.25 | Inhibition of bacterial Beta-lactamase AmpC (20 - 377) (unknown origin) expresse... | 33744439 |
| Unchecked | IC50 | = | 18580.0 | nM | 4.73 | Inhibition of bacterial Beta-lactamase SFH-1 (3 - 234) expressed in Escherichia ... | 33744439 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 33744439 | 10.1016/j.bmcl.2021.127956 | Unchecked | 6 |
| 33744439 | 10.1016/j.bmcl.2021.127956 | Beta-lactamase TEM | 1 |
Data from ChEMBL 36 via Core Engine