Compound Detail
CHEMBL5558687
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Basic Information
| ChEMBL ID | CHEMBL5558687 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MOPVQCPNFIFWKC-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
317.7
MW (Da)
2.27
ALogP
6
HBA
2
HBD
92.9
PSA (Ų)
0.72
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.29
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| YTH domain-containing protein 1 CHEMBL5169187 | IC50 | 6.29 | 6.29 | 510.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| YTH domain-containing protein 1 | IC50 | = | 510.0 | nM | 6.29 | Inhibition of GST-tagged YTHDC1 (unknown origin) by HTRF assay | 38787793 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38787793 | 10.1021/acs.jmedchem.4c00599 | YTH domain-containing protein 1 | 1 |
| 38787793 | 10.1021/acs.jmedchem.4c00599 | THP-1 | 1 |
Data from ChEMBL 36 via Core Engine