Compound Detail
CHEMBL5412324
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Basic Information
| ChEMBL ID | CHEMBL5412324 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YMHFGWCDFRAHLI-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
430.5
MW (Da)
3.55
ALogP
7
HBA
2
HBD
88.7
PSA (Ų)
0.41
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.25
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| N6-adenosine-methyltransferase catalytic subunit CHEMBL4739695 | IC50 | 8.25 | 8.25 | 5.7 | 1 |
| MOLM-13 CHEMBL3706572 | IC50 | 5.93 | 5.93 | 1183.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| N6-adenosine-methyltransferase catalytic subunit | IC50 | = | 5.67 | nM | 8.25 | Inhibition of full length His-tagged METTL3 (unknown origin) co-expressed with f... | - |
| MOLM-13 | IC50 | = | 1183.0 | nM | 5.93 | Antiproliferative activity against human MOLM-13 cells incubated for 6 days by C... | - |
Data from ChEMBL 36 via Core Engine