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Assay Detail

CHEMBL1212405

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

Functional
Antagonist activity at human wild type AR expressed in human MDA-MB-435 cells by transactivation assay
30
Total Activities
30
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Functional
Organism Homo sapiens
Cell Type MDA-MB-435
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Androgen receptor (CHEMBL1871)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Design and synthesis of 4-[3,5-dioxo-11-oxa-4,9-diazatricyclo[5.3.1.0(2,6)]undec-4-yl]-2-trifluoromethyl-benzonitriles as androgen receptor antagonists.
Xiao HY, Balog A, Attar RM, Fairfax D, Fleming LB, Holst CL, Martin GS, Rossiter LM, Chen J, Cvjic ME, Dell-John J, Geng J, Gottardis MM, Han WC, Nation A, Obermeier M, Rizzo CA, Schweizer L, Spires T, Shan W, Gavai A, Salvati ME, Vite G.
Bioorg Med Chem Lett (2010) 20 : 4491 -4495
PubMed 20584610 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 30 7.11 8.13

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL1210783 1 8.13
CHEMBL1210151 1 8.13
CHEMBL1210033 1 8.03
CHEMBL1210152 1 7.96
CHEMBL1210842 1 7.92
CHEMBL1209903 1 7.85
CHEMBL1209972 1 7.80
CHEMBL1210910 1 7.62
CHEMBL1210214 1 7.51
CHEMBL1210908 1 7.50
CHEMBL1210150 1 7.43
CHEMBL1210034 1 7.41
CHEMBL1209970 1 7.27
CHEMBL1208805 1 7.27
CHEMBL1209973 1 7.19
CHEMBL1209906 1 7.16
CHEMBL1210036 1 7.07
CHEMBL1210090 1 7.00
CHEMBL1209904 1 6.89
CHEMBL1208812 1 6.89
CHEMBL1210091 1 6.77
CHEMBL409 BICALUTAMIDE 4.0 1 6.76
CHEMBL1210909 1 6.74
CHEMBL1210035 1 6.69
CHEMBL1209905 1 6.67
CHEMBL1210907 1 6.50
CHEMBL1209971 1 6.06
CHEMBL1210841 1 6.06
CHEMBL1210840 1 5.67
CHEMBL1210843 1 5.41

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL1210783 IC50 = 7.4 nM 8.13
CHEMBL1210151 IC50 = 7.4 nM 8.13
CHEMBL1210033 IC50 = 9.3 nM 8.03
CHEMBL1210152 IC50 = 11.0 nM 7.96
CHEMBL1210842 IC50 = 12.0 nM 7.92
CHEMBL1209903 IC50 = 14.0 nM 7.85
CHEMBL1209972 IC50 = 16.0 nM 7.80
CHEMBL1210910 IC50 = 24.0 nM 7.62
CHEMBL1210214 IC50 = 31.0 nM 7.51
CHEMBL1210908 IC50 = 32.0 nM 7.50
CHEMBL1210150 IC50 = 37.0 nM 7.43
CHEMBL1210034 IC50 = 39.0 nM 7.41
CHEMBL1209970 IC50 = 54.0 nM 7.27
CHEMBL1208805 IC50 = 54.0 nM 7.27
CHEMBL1209973 IC50 = 65.0 nM 7.19
CHEMBL1209906 IC50 = 69.0 nM 7.16
CHEMBL1210036 IC50 = 85.0 nM 7.07
CHEMBL1210090 IC50 = 99.0 nM 7.00
CHEMBL1209904 IC50 = 129.0 nM 6.89
CHEMBL1208812 IC50 = 128.0 nM 6.89
CHEMBL1210091 IC50 = 170.0 nM 6.77
CHEMBL409 BICALUTAMIDE IC50 = 173.0 nM 6.76
CHEMBL1210909 IC50 = 182.0 nM 6.74
CHEMBL1210035 IC50 = 205.0 nM 6.69
CHEMBL1209905 IC50 = 215.0 nM 6.67
CHEMBL1210907 IC50 = 313.0 nM 6.50
CHEMBL1209971 IC50 = 876.0 nM 6.06
CHEMBL1210841 IC50 = 873.0 nM 6.06
CHEMBL1210840 IC50 = 2144.0 nM 5.67
CHEMBL1210843 IC50 = 3900.0 nM 5.41