Compound Detail
CHEMBL4161122
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Basic Information
| ChEMBL ID | CHEMBL4161122 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YCALIZUKAFUQCH-UHFFFAOYSA-N |
| Parent Compound | CHEMBL372303 |
| Active Moiety | CHEMBL372303 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
295.3
MW (Da)
2.18
ALogP
3
HBA
2
HBD
65.2
PSA (Ų)
0.73
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Transient receptor potential cation channel subfamily M member 2 CHEMBL1250402 | IC50 | 7.6 | 7.6 | 25.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Transient receptor potential cation channel subfamily M member 2 | IC50 | = | 25.0 | nM | 7.6 | Inhibition of human FLAG-tagged TRPM2 expressed in HEK293 cells assessed as redu... | 29019677 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29019677 | 10.1021/acs.jnatprod.7b00515 | Transient receptor potential cation channel subfamily M member 2 | 2 |
Data from ChEMBL 36 via Core Engine