Compound Detail
CHEMBL4165736
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Basic Information
| ChEMBL ID | CHEMBL4165736 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GCBFQVKSESVEOZ-AWQFTUOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
382.3
MW (Da)
5.14
ALogP
3
HBA
3
HBD
56.6
PSA (Ų)
0.39
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.35
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| rRNA adenine N-6-methyltransferase CHEMBL4295563 | IC50 | 6.35 | 6.35 | 450.0 | 1 |
| 23S rRNA methylase leader peptide CHEMBL5291611 | IC50 | 6.35 | 6.35 | 450.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| rRNA adenine N-6-methyltransferase | IC50 | = | 450.0 | nM | 6.35 | Inhibition of Staphylococcus aureus ErmC' expressed in Bacillus subtilis BD170 a... | 29396363 |
| 23S rRNA methylase leader peptide | IC50 | = | 450.0 | nM | 6.35 | Inhibition of Escherichia coli ErmC methyltransferase | 37122541 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29396363 | 10.1016/j.ejmech.2017.11.032 | rRNA adenine N-6-methyltransferase | 1 |
| 37122541 | 10.1039/d2md00459c | 23S rRNA methylase leader peptide | 1 |
Data from ChEMBL 36 via Core Engine