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Assay Detail

CHEMBL3389009

Review assay metadata, readout intent, target linkage, and publication context from the same page.

Binding
Inhibition of IDH1 R132C mutant in human HT1080 cells assessed as reduction in D2HG production incubated for 48 hrs by HPLC-MS method
12
Total Activities
12
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type HT-1080
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.
Liu Z, Yao Y, Kogiso M, Zheng B, Deng L, Qiu JJ, Dong S, Lv H, Gallo JM, Li XN, Song Y.
J Med Chem (2014) 57 : 8307 -8318
PubMed 25271760 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 12 5.47 5.96

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3343444 1 5.96
CHEMBL3343462 1 5.96
CHEMBL2386125 1 5.62
CHEMBL3343463 1 5.50
CHEMBL3343445 1 5.42
CHEMBL3343464 1 5.20
CHEMBL2386128 1 5.07
CHEMBL2386127 1 5.01
CHEMBL3343434 1 -
CHEMBL2386126 1 -
CHEMBL2386129 1 -
CHEMBL3343439 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3343444 IC50 = 1100.0 nM 5.96
CHEMBL3343462 IC50 = 1100.0 nM 5.96
CHEMBL2386125 IC50 = 2400.0 nM 5.62
CHEMBL3343463 IC50 = 3200.0 nM 5.50
CHEMBL3343445 IC50 = 3800.0 nM 5.42
CHEMBL3343464 IC50 = 6300.0 nM 5.20
CHEMBL2386128 IC50 = 8500.0 nM 5.07
CHEMBL2386127 IC50 = 9700.0 nM 5.01
CHEMBL3343434 IC50 - -
CHEMBL2386126 IC50 > 30000.0 nM -
CHEMBL2386129 IC50 - -
CHEMBL3343439 IC50 > 30000.0 nM -