Compound Detail
CHEMBL4640702
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Basic Information
| ChEMBL ID | CHEMBL4640702 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SDYHQCDQJPLOQK-QMMMGPOBSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
308.1
MW (Da)
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 3 meas. best 8.85
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 8.85 | 8.235 | 1.4 | 2 |
| Class A carbapenemase KPC-2 CHEMBL5437 | Ki | 6.82 | 6.82 | 150.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 1.4 | nM | 8.85 | Inhibition of recombinant Escherichia coli OXA-48 using nitrocefin as substrate ... | 32150407 |
| Unchecked | Ki | = | 24.0 | nM | 7.62 | Inhibition of recombinant Escherichia coli NDM-1 using imipenem as substrate pre... | 32150407 |
| Class A carbapenemase KPC-2 | Ki | = | 150.0 | nM | 6.82 | Inhibition of recombinant Escherichia coli KPC-2 using nitrocefin as substrate p... | 32150407 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 32150407 | 10.1021/acs.jmedchem.9b01976 | Unchecked | 12 |
| 32150407 | 10.1021/acs.jmedchem.9b01976 | Beta-lactamase | 2 |
| 32150407 | 10.1021/acs.jmedchem.9b01976 | Class A carbapenemase KPC-2 | 1 |
Data from ChEMBL 36 via Core Engine