Compound Detail
CHEMBL274764
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Basic Information
| ChEMBL ID | CHEMBL274764 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DZRJNQFWWIUBDI-JYLGIWJRSA-N |
1
Targets
4
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
221.3
MW (Da)
0.56
ALogP
3
HBA
3
HBD
83.5
PSA (Ų)
0.63
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.39
Ki 2 meas. best 4.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Solute carrier family 15 member 1 CHEMBL4605 | Ki | 4.4 | 4.4 | 39800.0 | 1 |
| Solute carrier family 15 member 1 CHEMBL4605 | IC50 | 4.39 | 4.39 | 40500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Solute carrier family 15 member 1 | Ki | = | 39800.0 | nM | 4.4 | Affinity fo the compound against human Intestinal peptide transporter PepT1 in C... | 14761208 |
| Solute carrier family 15 member 1 | IC50 | = | 40500.0 | nM | 4.39 | Concentration required to inhibit the maximum [14C]Gly-Sar uptake by human Intes... | 14761208 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 14761208 | 10.1021/jm031022+ | Solute carrier family 15 member 1 | 2 |
| 14761208 | 10.1021/jm031022+ | NON-PROTEIN TARGET | 1 |
| 14761208 | 10.1021/jm031022+ | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine