Compound Detail
CHEMBL4862754
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Basic Information
| ChEMBL ID | CHEMBL4862754 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MFZXSNYAQBIVDS-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
411.5
MW (Da)
1.79
ALogP
6
HBA
3
HBD
113.3
PSA (Ų)
0.67
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.2
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Bromodomain-containing protein 4 CHEMBL1163125 | IC50 | 5.2 | 5.2 | 6309.6 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Bromodomain-containing protein 4 | IC50 | = | 6309.57 | nM | 5.2 | Inhibition of BRD4 BD1 (unknown origin) by TR-FRET assay | 34413961 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 34413961 | 10.1021/acsmedchemlett.1c00294 | No relevant target | 2 |
| 34413961 | 10.1021/acsmedchemlett.1c00294 | Transcription initiation factor TFIID subunit 1 | 1 |
| 34413961 | 10.1021/acsmedchemlett.1c00294 | Bromodomain-containing protein 4 | 1 |
| 34413961 | 10.1021/acsmedchemlett.1c00294 | ATPase family AAA domain-containing protein 2 | 1 |
| 34413961 | 10.1021/acsmedchemlett.1c00294 | ADMET | 1 |
| 34413961 | 10.1021/acsmedchemlett.1c00294 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine