Assay Detail
Binding
CHEMBL3389006
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibition of human IDH1 R132C mutant expressed in Escherichia coli BL21-CodonPlus assessed as reduction in NADPH consumption
12
Total Activities
12
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
Inhibition of cancer-associated mutant isocitrate dehydrogenases: synthesis, structure-activity relationship, and selective antitumor activity.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Ki | 12 | 5.95 | 6.92 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL2386125 | — | — | 1 | 6.92 |
| CHEMBL3343444 | — | — | 1 | 6.58 |
| CHEMBL2386128 | — | — | 1 | 6.57 |
| CHEMBL3343445 | — | — | 1 | 6.38 |
| CHEMBL3343463 | — | — | 1 | 6.25 |
| CHEMBL3343464 | — | — | 1 | 6.21 |
| CHEMBL3343462 | — | — | 1 | 6.10 |
| CHEMBL2386127 | — | — | 1 | 5.75 |
| CHEMBL2386129 | — | — | 1 | 5.62 |
| CHEMBL3343434 | — | — | 1 | 5.18 |
| CHEMBL2386126 | — | — | 1 | 4.98 |
| CHEMBL3343439 | — | — | 1 | 4.83 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL2386125 | — | Ki | = | 120.0 | nM | 6.92 |
| CHEMBL3343444 | — | Ki | = | 260.0 | nM | 6.58 |
| CHEMBL2386128 | — | Ki | = | 270.0 | nM | 6.57 |
| CHEMBL3343445 | — | Ki | = | 420.0 | nM | 6.38 |
| CHEMBL3343463 | — | Ki | = | 560.0 | nM | 6.25 |
| CHEMBL3343464 | — | Ki | = | 620.0 | nM | 6.21 |
| CHEMBL3343462 | — | Ki | = | 800.0 | nM | 6.10 |
| CHEMBL2386127 | — | Ki | = | 1800.0 | nM | 5.75 |
| CHEMBL2386129 | — | Ki | = | 2400.0 | nM | 5.62 |
| CHEMBL3343434 | — | Ki | = | 6600.0 | nM | 5.18 |
| CHEMBL2386126 | — | Ki | = | 10500.0 | nM | 4.98 |
| CHEMBL3343439 | — | Ki | = | 14700.0 | nM | 4.83 |