Compound Detail
CHEMBL4293794
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Basic Information
| ChEMBL ID | CHEMBL4293794 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GFCZUPDCDRTINM-AATRIKPKSA-N |
2
Targets
9
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
397.4
MW (Da)
2.56
ALogP
8
HBA
2
HBD
111.2
PSA (Ų)
0.44
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 9 meas. best 6.73
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Connector enhancer of kinase suppressor of ras 1 CHEMBL4296242 | Kd | 6.73 | 6.73 | 186.0 | 3 |
| RAC-alpha serine/threonine-protein kinase CHEMBL4282 | Kd | 4.12 | 4.12 | 75200.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Connector enhancer of kinase suppressor of ras 1 | Kd | = | 186.0 | nM | 6.73 | Binding affinity to N-terminal GST tagged CNK PH domain (unknown origin) by SPR ... | - |
| Connector enhancer of kinase suppressor of ras 1 | Kd | = | 186.0 | nM | 6.73 | Binding affinity to CNKSR1 PH-domain (unknown origin) by SPR spectroscopy | - |
| Connector enhancer of kinase suppressor of ras 1 | Kd | = | 186.0 | nM | 6.73 | Binding affinity to N-terminal GST-tagged CNK PHD (unknown origin) by SPR assay | - |
| RAC-alpha serine/threonine-protein kinase | Kd | = | 75200.0 | nM | 4.12 | Binding affinity to His-tagged AKT1 PH domain (unknown origin) by SPR spectrosco... | - |
| RAC-alpha serine/threonine-protein kinase | Kd | = | 75200.0 | nM | 4.12 | Binding affinity to AKT PH-domain (unknown origin) at 0.01 to 50 uM by SPR spect... | - |
| RAC-alpha serine/threonine-protein kinase | Kd | = | 75200.0 | nM | 4.12 | Binding affinity to His-tagged AKT1 PHD (unknown origin) by SPR assay | - |
Data from ChEMBL 36 via Core Engine