Compound Detail
CHEMBL3972457
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Basic Information
| ChEMBL ID | CHEMBL3972457 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WOGGGGGHQZXITR-UHFFFAOYSA-N |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
377.6
MW (Da)
6.28
ALogP
2
HBA
0
HBD
25.8
PSA (Ų)
0.50
QED
1
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 4.3
IC50 1 meas. best 4.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Kinesin-like protein KIF20B CHEMBL2021752 | IC50 | 4.4 | 4.4 | 40000.0 | 1 |
| Kinesin family member 20B CHEMBL3988625 | EC50 | 4.3 | 4.3 | 50000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Kinesin-like protein KIF20B | IC50 | = | 40000.0 | nM | 4.4 | Inhibition of microtubule-stimulated ATPase activity of His-tagged human MPP1 (1... | - |
| Kinesin family member 20B | EC50 | = | 50000.0 | nM | 4.3 | Inhibition of MPP1 in African green monkey BSC1 cells assessed as induction of b... | - |
Data from ChEMBL 36 via Core Engine