Compound Detail
CHEMBL1471965
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Basic Information
| ChEMBL ID | CHEMBL1471965 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FXTBDJDNPHEMMV-ZOQHSEBNSA-N |
4
Targets
5
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
366.5
MW (Da)
4.71
ALogP
4
HBA
0
HBD
23.6
PSA (Ų)
0.58
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 6.28
EC50 1 meas.
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Prothrombin CHEMBL4471 | IC50 | 6.28 | 6.28 | 529.0 | 1 |
| Ephrin type-A receptor 4 CHEMBL1293259 | IC50 | 6.22 | 6.22 | 600.0 | 1 |
| 26S proteasome non-ATPase regulatory subunit 14 CHEMBL2007629 | IC50 | 6.15 | 6.15 | 703.0 | 1 |
| Alkaline phosphatase, germ cell type CHEMBL3402 | IC50 | 5.01 | 5.01 | 9810.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Prothrombin | IC50 | = | 529.0 | nM | 6.28 | PUBCHEM_BIOASSAY: Dose Response validation of uHTS RPN11 inhibitor hits using a ... | - |
| Ephrin type-A receptor 4 | IC50 | = | 600.0 | nM | 6.22 | PUBCHEM_BIOASSAY: Colorimetric assay for HTS discovery of chemical inhibitors of... | - |
| 26S proteasome non-ATPase regulatory subunit 14 | IC50 | = | 703.0 | nM | 6.15 | PUBCHEM_BIOASSAY: Dose response confirmation of uHTS RPN11 inhibitor hits in a F... | - |
| Alkaline phosphatase, germ cell type | IC50 | = | 9810.0 | nM | 5.01 | PUBCHEM_BIOASSAY: Luminescent assay for HTS discovery of chemical inhibitors of ... | - |
Data from ChEMBL 36 via Core Engine