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Assay Detail

CHEMBL1944172

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

Functional
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of 5H-dibenzo[b,e]azepine-10-carboxylic acid methyl ester-induced increase in intracellular calcium by Fluo4-AM based fluorometric assay
41
Total Activities
41
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Functional
Organism Homo sapiens
Cell Type HEK293
Confidence 9 — Direct single protein target
Curated By Autocuration

Publication

Tricyclic 3,4-dihydropyrimidine-2-thione derivatives as potent TRPA1 antagonists.
Gijsen HJ, Berthelot D, De Cleyn MA, Geuens I, Brône B, Mercken M.
Bioorg Med Chem Lett (2012) 22 : 797 -800
PubMed 22222037 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 41 6.28 7.89

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL1939826 1 7.89
CHEMBL1939972 1 7.30
CHEMBL1939833 1 7.16
CHEMBL1939828 1 7.12
CHEMBL1939822 1 7.07
CHEMBL1939978 1 6.89
CHEMBL1939832 1 6.68
CHEMBL1939836 1 6.51
CHEMBL1939980 1 6.30
CHEMBL1939976 1 6.19
CHEMBL1939977 1 6.15
CHEMBL1939984 1 6.11
CHEMBL1939982 1 5.96
CHEMBL1939831 1 5.82
CHEMBL1939823 1 5.77
CHEMBL1939990 1 5.75
CHEMBL1939981 1 5.68
CHEMBL1939835 1 5.56
CHEMBL1939979 1 5.51
CHEMBL1939825 1 5.41
CHEMBL1939985 1 5.09
CHEMBL1939834 1 -
CHEMBL1939991 1 -
CHEMBL1939830 1 -
CHEMBL1388908 1 -
CHEMBL1939829 1 -
CHEMBL1086310 1 -
CHEMBL1939827 1 -
CHEMBL1939824 1 -
CHEMBL1939987 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL1939826 IC50 = 13.0 nM 7.89
CHEMBL1939972 IC50 = 50.0 nM 7.30
CHEMBL1939833 IC50 = 70.0 nM 7.16
CHEMBL1939828 IC50 = 75.0 nM 7.12
CHEMBL1939822 IC50 = 85.0 nM 7.07
CHEMBL1939978 IC50 = 130.0 nM 6.89
CHEMBL1939832 IC50 = 210.0 nM 6.68
CHEMBL1939836 IC50 = 310.0 nM 6.51
CHEMBL1939980 IC50 = 500.0 nM 6.30
CHEMBL1939976 IC50 = 640.0 nM 6.19
CHEMBL1939977 IC50 = 710.0 nM 6.15
CHEMBL1939984 IC50 = 770.0 nM 6.11
CHEMBL1939982 IC50 = 1100.0 nM 5.96
CHEMBL1939831 IC50 = 1500.0 nM 5.82
CHEMBL1939823 IC50 = 1700.0 nM 5.77
CHEMBL1939990 IC50 = 1800.0 nM 5.75
CHEMBL1939981 IC50 = 2070.0 nM 5.68
CHEMBL1939835 IC50 = 2780.0 nM 5.56
CHEMBL1939979 IC50 = 3100.0 nM 5.51
CHEMBL1939825 IC50 = 3900.0 nM 5.41
CHEMBL1939985 IC50 = 8100.0 nM 5.09
CHEMBL1939988 IC50 > 10000.0 nM -
CHEMBL1567258 IC50 > 10000.0 nM -
CHEMBL1939983 IC50 > 10000.0 nM -
CHEMBL1364775 IC50 > 10000.0 nM -
CHEMBL1939986 IC50 > 10000.0 nM -
CHEMBL1939973 IC50 > 10000.0 nM -
CHEMBL1939974 IC50 > 10000.0 nM -
CHEMBL1939975 IC50 > 10000.0 nM -
CHEMBL1939989 IC50 > 10000.0 nM -
CHEMBL1469047 IC50 > 10000.0 nM -
CHEMBL1939834 IC50 > 10000.0 nM -
CHEMBL1492420 IC50 > 10000.0 nM -
CHEMBL1939987 IC50 > 10000.0 nM -
CHEMBL1939824 IC50 > 10000.0 nM -
CHEMBL1939827 IC50 > 10000.0 nM -
CHEMBL1086310 IC50 > 10000.0 nM -
CHEMBL1939829 IC50 > 10000.0 nM -
CHEMBL1388908 IC50 > 10000.0 nM -
CHEMBL1939830 IC50 > 10000.0 nM -
CHEMBL1939991 IC50 > 10000.0 nM -