Compound Detail
CHEMBL1447034
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Basic Information
| ChEMBL ID | CHEMBL1447034 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UORZCPZFZNBVDZ-UHFFFAOYSA-N |
12
Targets
16
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
243.3
MW (Da)
2.84
ALogP
2
HBA
2
HBD
49.3
PSA (Ų)
0.75
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 14 meas. best 6.07
EC50 2 meas. best 4.66
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| DNA dC->dU-editing enzyme APOBEC-3G CHEMBL1741217 | IC50 | 6.07 | 5.295 | 858.0 | 2 |
| DNA dC->dU-editing enzyme APOBEC-3A CHEMBL1741179 | IC50 | 5.77 | 5.475 | 1700.0 | 2 |
| Nuclear receptor subfamily 4immunitygroup A member 1 CHEMBL1293229 | IC50 | 5.72 | 5.72 | 1889.4 | 1 |
| Tyrosine-protein phosphatase non-receptor type 7 CHEMBL2219 | IC50 | 5.67 | 5.465 | 2120.0 | 2 |
| Induced myeloid leukemia cell differentiation protein Mcl-1 CHEMBL4361 | IC50 | 5.5 | 5.5 | 3170.5 | 1 |
| Dual specificity protein phosphatase 6 CHEMBL5511 | IC50 | 5.22 | 5.215 | 5963.0 | 2 |
| Heat shock 70 kDa protein 1A CHEMBL5460 | IC50 | 5.14 | 5.14 | 7180.0 | 1 |
| Dual specificity protein phosphatase 1 CHEMBL6026 | IC50 | 5.1 | 5.1 | 8000.0 | 1 |
| Heat shock cognate 71 kDa protein CHEMBL1275223 | IC50 | 4.66 | 4.66 | 21900.0 | 1 |
| Zinc finger protein mex-5 CHEMBL1293319 | EC50 | 4.66 | 4.66 | 21695.0 | 1 |
| RNA-binding protein pos-1 CHEMBL1293304 | EC50 | 4.43 | 4.43 | 37367.0 | 1 |
| Glyceraldehyde-3-phosphate dehydrogenase CHEMBL2284 | IC50 | 4.09 | 4.09 | 80800.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 37874947 | 10.1021/acs.jmedchem.3c01277 | Dual specificity protein phosphatase 1 | 1 |
Data from ChEMBL 36 via Core Engine