Assay Detail
Binding
CHEMBL5261223
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibition of human N-terminal 6His-tagged IDH1 R132H mutant expressed in Escherichia coli Rosetta2 (DE3) assessed as effect on intracellular 2-HG level incubated for 60 mins in presence of alpha-ketoglutarate and NADPH by LC/MS/MS analysis
26
Total Activities
26
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Homo sapiens |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Target
Isocitrate dehydrogenase [NADP] cytoplasmic (CHEMBL2007625) ↗| Type | SINGLE PROTEIN |
| Organism | Homo sapiens |
Publication
Optimization of 3-Pyrimidin-4-yl-oxazolidin-2-ones as Allosteric and Mutant Specific Inhibitors of IDH1.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 26 | 6.48 | 8.00 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL3677013 | — | — | 1 | 8.00 |
| CHEMBL4169151 | — | — | 1 | 7.70 |
| CHEMBL4216196 | — | — | 1 | 7.09 |
| CHEMBL3672144 | — | — | 1 | 7.03 |
| CHEMBL5273829 | — | — | 1 | 7.01 |
| CHEMBL5269195 | — | — | 1 | 6.92 |
| CHEMBL5289157 | — | — | 1 | 6.89 |
| CHEMBL3672163 | — | — | 1 | 6.89 |
| CHEMBL3639710 | — | — | 1 | 6.82 |
| CHEMBL3672192 | — | — | 1 | 6.75 |
| CHEMBL3677089 | — | — | 1 | 6.72 |
| CHEMBL3672097 | — | — | 1 | 6.66 |
| CHEMBL3672129 | — | — | 1 | 6.60 |
| CHEMBL5267963 | — | — | 1 | 6.60 |
| CHEMBL3672183 | — | — | 1 | 6.57 |
| CHEMBL3672135 | — | — | 1 | 6.52 |
| CHEMBL5277001 | — | — | 1 | 6.47 |
| CHEMBL3672198 | — | — | 1 | 6.46 |
| CHEMBL5273919 | — | — | 1 | 6.27 |
| CHEMBL5281535 | — | — | 1 | 6.16 |
| CHEMBL5272583 | — | — | 1 | 6.10 |
| CHEMBL3639759 | — | — | 1 | 5.68 |
| CHEMBL3672115 | — | — | 1 | 5.38 |
| CHEMBL3672098 | — | — | 1 | 5.34 |
| CHEMBL5290108 | — | — | 1 | 5.07 |
| CHEMBL3672116 | — | — | 1 | 4.71 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL3677013 | — | IC50 | = | 10.0 | nM | 8.00 |
| CHEMBL4169151 | — | IC50 | = | 20.0 | nM | 7.70 |
| CHEMBL4216196 | — | IC50 | = | 81.0 | nM | 7.09 |
| CHEMBL3672144 | — | IC50 | = | 94.0 | nM | 7.03 |
| CHEMBL5273829 | — | IC50 | = | 97.0 | nM | 7.01 |
| CHEMBL5269195 | — | IC50 | = | 120.0 | nM | 6.92 |
| CHEMBL5289157 | — | IC50 | = | 130.0 | nM | 6.89 |
| CHEMBL3672163 | — | IC50 | = | 130.0 | nM | 6.89 |
| CHEMBL3639710 | — | IC50 | = | 150.0 | nM | 6.82 |
| CHEMBL3672192 | — | IC50 | = | 180.0 | nM | 6.75 |
| CHEMBL3677089 | — | IC50 | = | 190.0 | nM | 6.72 |
| CHEMBL3672097 | — | IC50 | = | 220.0 | nM | 6.66 |
| CHEMBL3672129 | — | IC50 | = | 250.0 | nM | 6.60 |
| CHEMBL5267963 | — | IC50 | = | 250.0 | nM | 6.60 |
| CHEMBL3672183 | — | IC50 | = | 270.0 | nM | 6.57 |
| CHEMBL3672135 | — | IC50 | = | 300.0 | nM | 6.52 |
| CHEMBL5277001 | — | IC50 | = | 340.0 | nM | 6.47 |
| CHEMBL3672198 | — | IC50 | = | 350.0 | nM | 6.46 |
| CHEMBL5273919 | — | IC50 | = | 540.0 | nM | 6.27 |
| CHEMBL5281535 | — | IC50 | = | 700.0 | nM | 6.16 |
| CHEMBL5272583 | — | IC50 | = | 800.0 | nM | 6.10 |
| CHEMBL3639759 | — | IC50 | = | 2100.0 | nM | 5.68 |
| CHEMBL3672115 | — | IC50 | = | 4200.0 | nM | 5.38 |
| CHEMBL3672098 | — | IC50 | = | 4600.0 | nM | 5.34 |
| CHEMBL5290108 | — | IC50 | = | 8500.0 | nM | 5.07 |
| CHEMBL3672116 | — | IC50 | = | 19700.0 | nM | 4.71 |