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Assay Detail

CHEMBL960910

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Binding
Inhibition of aromatase after 30 mins by fluorescence assay
23
Total Activities
23
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Confidence 8 — Homologous single protein target
Curated By Intermediate

Target

Aromatase (CHEMBL1978)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Synthesis of casimiroin and optimization of its quinone reductase 2 and aromatase inhibitory activities.
Maiti A, Reddy PV, Sturdy M, Marler L, Pegan SD, Mesecar AD, Pezzuto JM, Cushman M.
J Med Chem (2009) 52 : 1873 -1884
PubMed 19265439 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 23 5.56 7.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL449065 1 7.00
CHEMBL488 AMINOGLUTETHIMIDE 4.0 1 6.57
CHEMBL455593 1 6.12
CHEMBL493173 1 6.02
CHEMBL490867 1 6.02
CHEMBL492763 1 5.90
CHEMBL506858 1 5.70
CHEMBL492382 1 5.57
CHEMBL492762 CASIMIROIN 1 5.41
CHEMBL493182 1 5.25
CHEMBL453233 1 5.24
CHEMBL493181 1 4.83
CHEMBL454226 1 4.73
CHEMBL493174 1 4.57
CHEMBL503538 1 4.50
CHEMBL482693 1 -
CHEMBL165 RESVERATROL 3.0 1 -
CHEMBL45 MELATONIN 4.0 1 -
CHEMBL453417 1 -
CHEMBL60376 1 -
CHEMBL424414 1 -
CHEMBL476126 1 -
CHEMBL450666 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL449065 IC50 = 100.0 nM 7.00
CHEMBL488 AMINOGLUTETHIMIDE IC50 = 270.0 nM 6.57
CHEMBL455593 IC50 = 760.0 nM 6.12
CHEMBL493173 IC50 = 960.0 nM 6.02
CHEMBL490867 IC50 = 960.0 nM 6.02
CHEMBL492763 IC50 = 1250.0 nM 5.90
CHEMBL506858 IC50 = 2020.0 nM 5.70
CHEMBL492382 IC50 = 2720.0 nM 5.57
CHEMBL492762 CASIMIROIN IC50 = 3920.0 nM 5.41
CHEMBL493182 IC50 = 5680.0 nM 5.25
CHEMBL453233 IC50 = 5760.0 nM 5.24
CHEMBL493181 IC50 = 14800.0 nM 4.83
CHEMBL454226 IC50 = 18470.0 nM 4.73
CHEMBL493174 IC50 = 26800.0 nM 4.57
CHEMBL503538 IC50 = 31500.0 nM 4.50
CHEMBL482693 IC50 > 98490.0 nM -
CHEMBL165 RESVERATROL IC50 - -
CHEMBL45 MELATONIN IC50 - -
CHEMBL453417 IC50 > 105800.0 nM -
CHEMBL60376 IC50 > 115600.0 nM -
CHEMBL424414 IC50 > 125700.0 nM -
CHEMBL476126 IC50 > 91290.0 nM -
CHEMBL450666 IC50 > 98400.0 nM -