Compound Detail
CHEMBL1445488
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Basic Information
| ChEMBL ID | CHEMBL1445488 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WRFNFMUNJVHPGT-UHFFFAOYSA-N |
10
Targets
16
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
498.5
MW (Da)
3.51
ALogP
10
HBA
2
HBD
135.3
PSA (Ų)
0.22
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 16 meas. best 6.98
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosine-protein phosphatase non-receptor type 7 CHEMBL2219 | IC50 | 6.98 | 6.98 | 105.0 | 1 |
| Dual specificity protein phosphatase 3 CHEMBL2635 | IC50 | 6.66 | 6.0017 | 218.0 | 6 |
| 72 kDa type IV collagenase CHEMBL333 | IC50 | 6.09 | 6.09 | 821.0 | 1 |
| Tyrosine-protein phosphatase non-receptor type 11 CHEMBL3864 | IC50 | 5.97 | 5.97 | 1080.0 | 1 |
| Tyrosine-protein phosphatase non-receptor type 5 CHEMBL2007628 | IC50 | 5.66 | 5.66 | 2180.0 | 1 |
| DNA (cytosine-5)-methyltransferase 1 CHEMBL1993 | IC50 | 5.38 | 5.38 | 4120.0 | 1 |
| 26S proteasome non-ATPase regulatory subunit 14 CHEMBL2007629 | IC50 | 5.17 | 5.17 | 6790.0 | 1 |
| Carboxy-terminal domain RNA polymerase II polypeptide A small phosphatase 1 CHEMBL1795098 | IC50 | 4.83 | 4.83 | 14782.0 | 1 |
| Prothrombin CHEMBL4471 | IC50 | 4.25 | 4.25 | 56600.0 | 1 |
| Dual specificity protein phosphatase 6 CHEMBL5511 | IC50 | 4.24 | 4.24 | 57300.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine