Compound Detail
CHEMBL5432943
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Basic Information
| ChEMBL ID | CHEMBL5432943 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YPCDPPPMOWHTLW-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
1
PK Parameters
4
Publications
0
Known Names
Molecular Properties
457.5
MW (Da)
3.14
ALogP
9
HBA
2
HBD
136.3
PSA (Ų)
0.47
QED
0
Ro5 Violations
9
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.92
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Kinesin-like protein KIFC1 CHEMBL3351200 | IC50 | 7.92 | 7.605 | 12.0 | 2 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| T1/2 | 3.583 | hr | Mus musculus |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Kinesin-like protein KIFC1 | IC50 | = | 12.0 | nM | 7.92 | Inhibition of N-terminal His-tagged full length recombinant human HSET assessed ... | 36749938 |
| Kinesin-like protein KIFC1 | IC50 | = | 51.0 | nM | 7.29 | Inhibition of N-terminal His-tagged full length recombinant human HSET assessed ... | 36749938 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 36749938 | 10.1021/acs.jmedchem.2c01591 | Kinesin-like protein KIFC1 | 2 |
| 36749938 | 10.1021/acs.jmedchem.2c01591 | Unchecked | 2 |
| 36749938 | 10.1021/acs.jmedchem.2c01591 | Kinesin-like protein KIF11 | 1 |
| 36749938 | 10.1021/acs.jmedchem.2c01591 | ADMET | 1 |
Data from ChEMBL 36 via Core Engine