Compound Detail
CHEMBL4578105
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Basic Information
| ChEMBL ID | CHEMBL4578105 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KCZNWOQJHMQCQM-ZROIWOOFSA-N |
4
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
415.5
MW (Da)
4.76
ALogP
7
HBA
1
HBD
88.4
PSA (Ų)
0.60
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 5.79
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Myc proto-oncogene protein CHEMBL1250348 | IC50 | 5.79 | 5.79 | 1630.0 | 1 |
| Lymphoma cell line CHEMBL614114 | IC50 | 4.95 | 4.95 | 11140.0 | 1 |
| NCI-H1975 CHEMBL614348 | IC50 | 4.25 | 4.25 | 56300.0 | 1 |
| NAMALVA CHEMBL614049 | IC50 | 4.14 | 4.14 | 72030.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Myc proto-oncogene protein | IC50 | = | 1630.0 | nM | 5.79 | Inhibition of Myc (unknown origin) expressed in HEK293T cells incubated for 16 h... | - |
| Lymphoma cell line | IC50 | = | 11140.0 | nM | 4.95 | Cytotoxicity against mouse E-mu-Myc lymphoma cells assessed as decrease in cell ... | - |
| NCI-H1975 | IC50 | = | 56300.0 | nM | 4.25 | Cytotoxicity against human NCI-H1975 cells assessed as decrease in cell viabilit... | - |
| NAMALVA | IC50 | = | 72030.0 | nM | 4.14 | Cytotoxicity against human NAMALWA cells assessed as decrease in cell viability ... | - |
Data from ChEMBL 36 via Core Engine