Assay Detail
Binding
CHEMBL4031659
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibition of human MDH1 expressed in Escherichia coli after 30 mins by oxaloacetate-dependent NADH oxidation assay
30
Total Activities
30
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 |
Publication
Methyl 3-(3-(4-(2,4,4-Trimethylpentan-2-yl)phenoxy)-propanamido)benzoate as a Novel and Dual Malate Dehydrogenase (MDH) 1/2 Inhibitor Targeting Cancer Metabolism.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 30 | 5.50 | 6.04 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL4096306 | — | — | 1 | 6.04 |
| CHEMBL4068781 | — | — | 1 | 5.97 |
| CHEMBL4065526 | — | — | 1 | 5.94 |
| CHEMBL4091027 | — | — | 1 | 5.93 |
| CHEMBL4098767 | — | — | 1 | 5.88 |
| CHEMBL4074947 | — | — | 1 | 5.85 |
| CHEMBL4074694 | — | — | 1 | 5.81 |
| CHEMBL4068233 | — | — | 1 | 5.64 |
| CHEMBL4087903 | — | — | 1 | 5.61 |
| CHEMBL4099949 | — | — | 1 | 5.52 |
| CHEMBL4095380 | — | — | 1 | 5.52 |
| CHEMBL4073085 | — | — | 1 | 5.46 |
| CHEMBL4086789 | — | — | 1 | 5.32 |
| CHEMBL4080721 | — | — | 1 | 5.29 |
| CHEMBL4105436 | — | — | 1 | 5.18 |
| CHEMBL4085170 | — | — | 1 | 5.17 |
| CHEMBL4078740 | — | — | 1 | 5.02 |
| CHEMBL4095604 | — | — | 1 | 4.74 |
| CHEMBL4069043 | — | — | 1 | 4.59 |
| CHEMBL4079103 | — | — | 1 | - |
| CHEMBL4103353 | — | — | 1 | - |
| CHEMBL4059591 | — | — | 1 | - |
| CHEMBL4087563 | — | — | 1 | - |
| CHEMBL4067849 | — | — | 1 | - |
| CHEMBL4060357 | — | — | 1 | - |
| CHEMBL4089556 | — | — | 1 | - |
| CHEMBL4086585 | — | — | 1 | - |
| CHEMBL4076058 | — | — | 1 | - |
| CHEMBL4073732 | — | — | 1 | - |
| CHEMBL4090211 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL4096306 | — | IC50 | = | 920.0 | nM | 6.04 |
| CHEMBL4068781 | — | IC50 | = | 1070.0 | nM | 5.97 |
| CHEMBL4065526 | — | IC50 | = | 1140.0 | nM | 5.94 |
| CHEMBL4091027 | — | IC50 | = | 1180.0 | nM | 5.93 |
| CHEMBL4098767 | — | IC50 | = | 1310.0 | nM | 5.88 |
| CHEMBL4074947 | — | IC50 | = | 1400.0 | nM | 5.85 |
| CHEMBL4074694 | — | IC50 | = | 1540.0 | nM | 5.81 |
| CHEMBL4068233 | — | IC50 | = | 2270.0 | nM | 5.64 |
| CHEMBL4087903 | — | IC50 | = | 2430.0 | nM | 5.61 |
| CHEMBL4099949 | — | IC50 | = | 3000.0 | nM | 5.52 |
| CHEMBL4095380 | — | IC50 | = | 3000.0 | nM | 5.52 |
| CHEMBL4073085 | — | IC50 | = | 3440.0 | nM | 5.46 |
| CHEMBL4086789 | — | IC50 | = | 4740.0 | nM | 5.32 |
| CHEMBL4080721 | — | IC50 | = | 5160.0 | nM | 5.29 |
| CHEMBL4105436 | — | IC50 | = | 6650.0 | nM | 5.18 |
| CHEMBL4085170 | — | IC50 | = | 6790.0 | nM | 5.17 |
| CHEMBL4078740 | — | IC50 | = | 9580.0 | nM | 5.02 |
| CHEMBL4095604 | — | IC50 | = | 18350.0 | nM | 4.74 |
| CHEMBL4069043 | — | IC50 | = | 25960.0 | nM | 4.59 |
| CHEMBL4079103 | — | IC50 | > | 40000.0 | nM | - |
| CHEMBL4103353 | — | IC50 | > | 40000.0 | nM | - |
| CHEMBL4059591 | — | IC50 | > | 40000.0 | nM | - |
| CHEMBL4087563 | — | IC50 | > | 40000.0 | nM | - |
| CHEMBL4067849 | — | IC50 | > | 40000.0 | nM | - |
| CHEMBL4060357 | — | IC50 | > | 40000.0 | nM | - |
| CHEMBL4089556 | — | IC50 | > | 40000.0 | nM | - |
| CHEMBL4086585 | — | IC50 | > | 40000.0 | nM | - |
| CHEMBL4076058 | — | IC50 | > | 40000.0 | nM | - |
| CHEMBL4073732 | — | IC50 | > | 40000.0 | nM | - |
| CHEMBL4090211 | — | IC50 | > | 40000.0 | nM | - |