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Assay Detail

CHEMBL684991

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Binding
Binding affinity for Glyoxalase I
11
Total Activities
11
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Expert

Target

Lactoylglutathione lyase (CHEMBL2424)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Role of hydrophobic interactions in binding S-(N-aryl/alkyl-N-hydroxycarbamoyl)glutathiones to the active site of the antitumor target enzyme glyoxalase I.
Kalsi A, Kavarana MJ, Lu T, Whalen DL, Hamilton DS, Creighton DJ.
J Med Chem (2000) 43 : 3981 -3986
PubMed 11052803 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 11 6.89 7.85

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL128872 1 7.85
CHEMBL127840 1 7.80
CHEMBL128836 1 7.75
CHEMBL131578 1 7.34
CHEMBL128935 1 6.80
CHEMBL129965 1 6.77
CHEMBL128447 1 6.75
CHEMBL129597 1 6.10
CHEMBL128867 1 5.93
CHEMBL129435 1 5.77
CHEMBL419969 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL128872 Ki = 14.0 nM 7.85
CHEMBL127840 Ki = 16.0 nM 7.80
CHEMBL128836 Ki = 18.0 nM 7.75
CHEMBL131578 Ki = 46.0 nM 7.34
CHEMBL128935 Ki = 160.0 nM 6.80
CHEMBL129965 Ki = 170.0 nM 6.77
CHEMBL128447 Ki = 180.0 nM 6.75
CHEMBL129597 Ki = 800.0 nM 6.10
CHEMBL128867 Ki = 1180.0 nM 5.93
CHEMBL129435 Ki = 1700.0 nM 5.77
CHEMBL419969 Ki = 183000.0 nM -