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Assay Detail

CHEMBL4481758

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Binding
Inhibition of human ERG
35
Total Activities
35
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Publication

3,5-Dialkoxypyridine analogues of bedaquiline are potent antituberculosis agents with minimal inhibition of the hERG channel.
Sutherland HS, Tong AST, Choi PJ, Blaser A, Conole D, Franzblau SG, Lotlikar MU, Cooper CB, Upton AM, Denny WA, Palmer BD.
Bioorg Med Chem (2019) 27 : 1292 -1307
PubMed 30803745 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 35 5.33 5.80

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4543900 1 5.80
CHEMBL376488 BEDAQUILINE 4.0 1 5.80
CHEMBL4574425 1 5.77
CHEMBL4593713 1 5.66
CHEMBL4519972 1 5.66
CHEMBL4570895 1 5.62
CHEMBL4578975 1 5.58
CHEMBL4553350 1 5.51
CHEMBL4519008 1 5.36
CHEMBL4586271 1 5.35
CHEMBL4561342 1 5.35
CHEMBL4532620 1 5.26
CHEMBL4585644 1 5.24
CHEMBL4537029 1 5.23
CHEMBL4591849 1 5.03
CHEMBL4565089 1 5.00
CHEMBL4534204 1 5.00
CHEMBL4550410 1 4.97
CHEMBL4590996 1 4.96
CHEMBL4529465 TBAJ-587 1.0 1 4.89
CHEMBL4554862 1 4.88
CHEMBL4524270 1 -
CHEMBL4548735 1 -
CHEMBL4525464 1 -
CHEMBL4580150 1 -
CHEMBL4543668 1 -
CHEMBL4553146 TBAJ-876 2.0 1 -
CHEMBL4551182 1 -
CHEMBL4530411 1 -
CHEMBL4542973 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4543900 IC50 = 1600.0 nM 5.80
CHEMBL376488 BEDAQUILINE IC50 = 1600.0 nM 5.80
CHEMBL4574425 IC50 = 1700.0 nM 5.77
CHEMBL4593713 IC50 = 2200.0 nM 5.66
CHEMBL4519972 IC50 = 2200.0 nM 5.66
CHEMBL4570895 IC50 = 2400.0 nM 5.62
CHEMBL4578975 IC50 = 2600.0 nM 5.58
CHEMBL4553350 IC50 = 3100.0 nM 5.51
CHEMBL4519008 IC50 = 4400.0 nM 5.36
CHEMBL4586271 IC50 = 4500.0 nM 5.35
CHEMBL4561342 IC50 = 4500.0 nM 5.35
CHEMBL4532620 IC50 = 5500.0 nM 5.26
CHEMBL4585644 IC50 = 5800.0 nM 5.24
CHEMBL4537029 IC50 = 5900.0 nM 5.23
CHEMBL4591849 IC50 = 9400.0 nM 5.03
CHEMBL4565089 IC50 = 10000.0 nM 5.00
CHEMBL4534204 IC50 = 9900.0 nM 5.00
CHEMBL4550410 IC50 = 10600.0 nM 4.97
CHEMBL4590996 IC50 = 11000.0 nM 4.96
CHEMBL4529465 TBAJ-587 IC50 = 13000.0 nM 4.89
CHEMBL4554862 IC50 = 13300.0 nM 4.88
CHEMBL4560398 IC50 > 10000.0 nM -
CHEMBL4531693 IC50 > 10000.0 nM -
CHEMBL4555888 IC50 > 10000.0 nM -
CHEMBL4569766 IC50 > 10000.0 nM -
CHEMBL4530550 IC50 > 10000.0 nM -
CHEMBL4542973 IC50 > 10000.0 nM -
CHEMBL4530411 IC50 > 30000.0 nM -
CHEMBL4551182 IC50 > 30000.0 nM -
CHEMBL4553146 TBAJ-876 IC50 > 30000.0 nM -
CHEMBL4543668 IC50 > 10000.0 nM -
CHEMBL4580150 IC50 > 10000.0 nM -
CHEMBL4525464 IC50 > 10000.0 nM -
CHEMBL4548735 IC50 > 10000.0 nM -
CHEMBL4524270 IC50 > 10000.0 nM -