Compound Detail
CHEMBL3527599
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Basic Information
| ChEMBL ID | CHEMBL3527599 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BCKXLBQYZLBQEK-KVVVOXFISA-M |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
304.4
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 4.78
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cytochrome P450 1A2 CHEMBL1075125 | Ki | 4.78 | 4.78 | 16700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cytochrome P450 1A2 | Ki | = | 16700.0 | nM | 4.78 | Competitive inhibition of rat recombinant CYP1A2 expressed in Escherichia coli a... | 22331994 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22331994 | 10.1124/dmd.111.044057 | Cytochrome P450 1A2 | 1 |
Data from ChEMBL 36 via Core Engine