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Assay Detail

CHEMBL935783

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

Binding
Inhibition of malate dehydrogenase
33
Total Activities
32
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Confidence 0 — Uncurated / Unknown
Curated By Autocuration

Target

Unchecked (CHEMBL612545)
Type UNCHECKED

Publication

Comprehensive mechanistic analysis of hits from high-throughput and docking screens against beta-lactamase.
Babaoglu K, Simeonov A, Irwin JJ, Nelson ME, Feng B, Thomas CJ, Cancian L, Costi MP, Maltby DA, Jadhav A, Inglese J, Austin CP, Shoichet BK.
J Med Chem (2008) 51 : 2502 -2511
PubMed 18333608 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 33 4.76 5.30

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL409906 1 5.30
CHEMBL275938 AURINTRICARBOXYLIC ACID 1 5.30
CHEMBL259355 1 4.82
CHEMBL261208 1 4.75
CHEMBL258670 1 4.70
CHEMBL6246 ELLAGIC ACID 2.0 1 4.26
CHEMBL437061 1 4.19
CHEMBL354646 1 -
CHEMBL264945 1 -
CHEMBL258465 1 -
CHEMBL405386 1 -
CHEMBL260676 1 -
CHEMBL436913 1 -
CHEMBL264947 1 -
CHEMBL259139 1 -
CHEMBL261687 1 -
CHEMBL261688 1 -
CHEMBL404957 1 -
CHEMBL428814 1 -
CHEMBL405912 1 -
CHEMBL260148 2 -
CHEMBL265957 1 -
CHEMBL261259 1 -
CHEMBL404954 1 -
CHEMBL261122 1 -
CHEMBL259018 1 -
CHEMBL406555 1 -
CHEMBL408636 1 -
CHEMBL258699 1 -
CHEMBL259140 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL275938 AURINTRICARBOXYLIC ACID IC50 = 5000.0 nM 5.30
CHEMBL409906 IC50 = 5000.0 nM 5.30
CHEMBL259355 IC50 = 15000.0 nM 4.82
CHEMBL261208 IC50 = 18000.0 nM 4.75
CHEMBL258670 IC50 = 20000.0 nM 4.70
CHEMBL6246 ELLAGIC ACID IC50 = 55000.0 nM 4.26
CHEMBL437061 IC50 = 65000.0 nM 4.19
CHEMBL354646 IC50 - -
CHEMBL261812 IC50 > 600000.0 nM -
CHEMBL258465 IC50 - -
CHEMBL405386 IC50 - -
CHEMBL260676 IC50 - -
CHEMBL436913 IC50 - -
CHEMBL264947 IC50 - -
CHEMBL259139 IC50 - -
CHEMBL261687 IC50 > 600000.0 nM -
CHEMBL261688 IC50 - -
CHEMBL404957 IC50 > 600000.0 nM -
CHEMBL264945 IC50 - -
CHEMBL409024 IC50 > 600000.0 nM -
CHEMBL428814 IC50 - -
CHEMBL405912 IC50 - -
CHEMBL260148 IC50 > 600000.0 nM -
CHEMBL258699 IC50 - -
CHEMBL265957 IC50 = 200000.0 nM -
CHEMBL261259 IC50 > 600000.0 nM -
CHEMBL408636 IC50 > 600000.0 nM -
CHEMBL404954 IC50 > 600000.0 nM -
CHEMBL406555 IC50 - -
CHEMBL260148 IC50 > 600000.0 nM -
CHEMBL259140 IC50 - -
CHEMBL261122 IC50 - -
CHEMBL259018 IC50 > 600000.0 nM -