Compound Detail
CHEMBL284575
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Basic Information
| ChEMBL ID | CHEMBL284575 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FIHRCVGMRDXVHA-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
11
Publications
0
Known Names
Molecular Properties
244.3
MW (Da)
3.68
ALogP
3
HBA
1
HBD
38.9
PSA (Ų)
0.66
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.58
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Amyloid-beta precursor protein CHEMBL2487 | Ki | 7.58 | 7.58 | 26.2 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Amyloid-beta precursor protein | Ki | = | 26.2 | nM | 7.58 | Displacement of [125I]TZDM from amyloid beta (1 to 42) aggregates in Alzheimer's... | 21478020 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11311068 | 10.1021/jm001104n | NON-PROTEIN TARGET | 2 |
| 11311068 | 10.1021/jm001104n | NCI-H226 | 1 |
| 11311068 | 10.1021/jm001104n | NCI-H460 | 1 |
| 11311068 | 10.1021/jm001104n | HCC 2998 | 1 |
| 11311068 | 10.1021/jm001104n | OVCAR-4 | 1 |
| 11311068 | 10.1021/jm001104n | OVCAR-5 | 1 |
| 11311068 | 10.1021/jm001104n | MCF7 | 1 |
| 11311068 | 10.1021/jm001104n | T47D | 1 |
| 11311068 | 10.1021/jm001104n | Unchecked | 1 |
| 21478020 | 10.1016/j.bmc.2011.03.029 | Amyloid-beta precursor protein | 1 |
| 21478020 | 10.1016/j.bmc.2011.03.029 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine