Compound Detail
CHEMBL1061
GLITAZONE Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL1061 |
| Name | GLITAZONE |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NKOHRVBBQISBSB-UHFFFAOYSA-N |
1
Targets
5
Activities
2
Assay Types
0
PK Parameters
20
Publications
0
Known Names
Molecular Properties
223.2
MW (Da)
1.29
ALogP
4
HBA
2
HBD
66.4
PSA (Ų)
0.79
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 4.85
Ki 1 meas. best 6.22
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| CDGSH iron-sulfur domain-containing protein 1 CHEMBL1795168 | Ki | 6.22 | 6.22 | 598.0 | 1 |
| CDGSH iron-sulfur domain-containing protein 1 CHEMBL1795168 | IC50 | 4.85 | 4.85 | 14000.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| CDGSH iron-sulfur domain-containing protein 1 | Ki | = | 598.0 | nM | 6.22 | Displacement of [3H]rosiglitazone from recombinant human C-terminal His-tagged M... | 27687671 |
| CDGSH iron-sulfur domain-containing protein 1 | IC50 | = | 14000.0 | nM | 4.85 | Displacement of [3H]-rosiglitazone from human recombinant C-terminal His-tagged ... | 21782425 |
| CDGSH iron-sulfur domain-containing protein 1 | IC50 | = | 14000.0 | nM | 4.85 | Displacement of [3H]rosiglitazone from recombinant human C-terminal His-tagged M... | 27687671 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15109648 | 10.1016/j.bmcl.2004.02.087 | PC-12 | 3 |
| 27687671 | 10.1016/j.bmcl.2016.09.009 | CDGSH iron-sulfur domain-containing protein 1 | 2 |
| 22970990 | 10.1021/jm301204r | Malate dehydrogenase, cytoplasmic | 1 |
| 15109648 | 10.1016/j.bmcl.2004.02.087 | No relevant target | 1 |
| 22970990 | 10.1021/jm301204r | Malate dehydrogenase, mitochondrial | 1 |
| 22970990 | 10.1021/jm301204r | L-lactate dehydrogenase B chain | 1 |
| 22970990 | 10.1021/jm301204r | Glutamate dehydrogenase 1, mitochondrial | 1 |
| 22970990 | 10.1021/jm301204r | Glyceraldehyde-3-phosphate dehydrogenase | 1 |
| 22970990 | 10.1021/jm301204r | 2-oxoglutarate dehydrogenase complex component E1 | 1 |
| 22970990 | 10.1021/jm301204r | Very long-chain specific acyl-CoA dehydrogenase, mitochondrial | 1 |
| 22970990 | 10.1021/jm301204r | Isocitrate dehydrogenase [NADP], mitochondrial | 1 |
| 22970990 | 10.1021/jm301204r | Medium-chain specific acyl-CoA dehydrogenase, mitochondrial | 1 |
| 21742494 | 10.1016/j.bmcl.2011.06.060 | Amine oxidase [flavin-containing] B | 1 |
| 22970990 | 10.1021/jm301204r | Dihydrolipoyl dehydrogenase, mitochondrial | 1 |
| 22970990 | 10.1021/jm301204r | Short-chain specific acyl-CoA dehydrogenase, mitochondrial | 1 |
| 22970990 | 10.1021/jm301204r | L-lactate dehydrogenase A chain | 1 |
| 22970990 | 10.1021/jm301204r | Pyruvate dehydrogenase E1 component subunit alpha, somatic form, mitochondrial | 1 |
| 22970990 | 10.1021/jm301204r | Dihydrolipoyllysine-residue succinyltransferase component of 2-oxoglutarate dehydrogenase complex, mitochondrial | 1 |
| 22970990 | 10.1021/jm301204r | Hydroxyacyl-coenzyme A dehydrogenase, mitochondrial | 1 |
| 21782425 | 10.1016/j.bmcl.2011.06.111 | CDGSH iron-sulfur domain-containing protein 1 | 1 |
Data from ChEMBL 36 via Core Engine