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Assay Detail

CHEMBL5156637

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Binding
Inhibition of Mycobacterium smegmatis ATP synthase
18
Total Activities
18
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Mycolicibacterium smegmatis
Confidence 0 — Uncurated / Unknown
Curated By Autocuration

Target

Unchecked (CHEMBL612545)
Type UNCHECKED

Publication

Synthesis and structure-activity relationships for a new class of tetrahydronaphthalene amide inhibitors of Mycobacterium tuberculosis.
Sutherland HS, Lu GL, Tong AST, Conole D, Franzblau SG, Upton AM, Lotlikar MU, Cooper CB, Palmer BD, Choi PJ, Denny WA.
Eur J Med Chem (2022) 229 : 114059 -114059
PubMed 34963068 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 18 5.82 8.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL376488 BEDAQUILINE 4.0 1 8.00
CHEMBL5203600 1 6.11
CHEMBL5174922 1 6.05
CHEMBL5182845 1 6.00
CHEMBL5187469 1 5.88
CHEMBL5197612 1 5.82
CHEMBL5184496 1 5.72
CHEMBL5184741 1 5.72
CHEMBL5189654 1 5.70
CHEMBL5201444 1 5.66
CHEMBL5201354 1 5.64
CHEMBL5200450 1 5.62
CHEMBL5191368 1 5.62
CHEMBL5194550 1 5.57
CHEMBL5178938 1 5.55
CHEMBL5190666 1 5.43
CHEMBL5189460 1 5.39
CHEMBL5189782 1 5.34

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL376488 BEDAQUILINE IC50 = 10.0 nM 8.00
CHEMBL5203600 IC50 = 770.0 nM 6.11
CHEMBL5174922 IC50 = 890.0 nM 6.05
CHEMBL5182845 IC50 = 1000.0 nM 6.00
CHEMBL5187469 IC50 = 1320.0 nM 5.88
CHEMBL5197612 IC50 = 1500.0 nM 5.82
CHEMBL5184496 IC50 = 1900.0 nM 5.72
CHEMBL5184741 IC50 = 1900.0 nM 5.72
CHEMBL5189654 IC50 = 2000.0 nM 5.70
CHEMBL5201444 IC50 = 2180.0 nM 5.66
CHEMBL5201354 IC50 = 2270.0 nM 5.64
CHEMBL5200450 IC50 = 2400.0 nM 5.62
CHEMBL5191368 IC50 = 2400.0 nM 5.62
CHEMBL5194550 IC50 = 2700.0 nM 5.57
CHEMBL5178938 IC50 = 2810.0 nM 5.55
CHEMBL5190666 IC50 = 3680.0 nM 5.43
CHEMBL5189460 IC50 = 4060.0 nM 5.39
CHEMBL5189782 IC50 = 4600.0 nM 5.34