Compound Detail
CHEMBL4281889
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Basic Information
| ChEMBL ID | CHEMBL4281889 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RYEOXOFCHTYTFM-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
384.4
MW (Da)
2.78
ALogP
6
HBA
2
HBD
113.8
PSA (Ų)
0.56
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.36
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Bile acid receptor CHEMBL2047 | EC50 | 5.36 | 5.36 | 4330.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Bile acid receptor | EC50 | = | 4330.0 | nM | 5.36 | Transactivation of full-length FXR (unknown origin) expressed in HEK293 cells af... | 30393515 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 30393515 | 10.1039/C8MD00272J | Bile acid receptor | 2 |
| 30393515 | 10.1039/C8MD00272J | HEK293 | 2 |
Data from ChEMBL 36 via Core Engine