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Assay Detail

CHEMBL749252

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Binding
Inhibition of NADH oxidase activity.
23
Total Activities
23
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Bos taurus
Confidence 7 — Homologous single protein target
Curated By Intermediate

Target

Mitochondrial complex I; NADH oxidoreductase (CHEMBL614865)
Type PROTEIN COMPLEX
Organism Bos taurus

Publication

Semisynthesis of antitumoral acetogenins: SAR of functionalized alkyl-chain bis-tetrahydrofuranic acetogenins, specific inhibitors of mitochondrial complex I.
Gallardo T, Zafra-Polo MC, Tormo JR, González MC, Franck X, Estornell E, Cortes D.
J Med Chem (2000) 43 : 4793 -4800
PubMed 11123988 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 23 9.01 9.60

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL145554 1 9.60
CHEMBL145449 BULLANIN 1 9.49
CHEMBL145222 1 9.48
CHEMBL358586 1 9.47
CHEMBL142276 1 9.47
CHEMBL141607 1 9.47
CHEMBL66691 MOTRILIN 1 9.39
CHEMBL144981 1 9.38
CHEMBL1159657 BULLATACIN 1 9.29
CHEMBL41177 SQUAMOCIN 1 9.23
CHEMBL142918 rolliniastatin-1 1 9.22
CHEMBL357666 1 9.19
CHEMBL359434 1 9.13
CHEMBL145455 1 9.02
CHEMBL145485 1 8.84
CHEMBL145624 GUANACONE 1 8.82
CHEMBL145484 1 8.78
CHEMBL145555 1 8.78
CHEMBL357600 1 8.68
CHEMBL145064 1 8.54
CHEMBL145563 1 8.30
CHEMBL145073 1 7.85
CHEMBL344296 1 7.75

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL145554 IC50 = 0.25 nM 9.60
CHEMBL145449 BULLANIN IC50 = 0.32 nM 9.49
CHEMBL145222 IC50 = 0.33 nM 9.48
CHEMBL358586 IC50 = 0.34 nM 9.47
CHEMBL142276 IC50 = 0.34 nM 9.47
CHEMBL141607 IC50 = 0.34 nM 9.47
CHEMBL66691 MOTRILIN IC50 = 0.41 nM 9.39
CHEMBL144981 IC50 = 0.42 nM 9.38
CHEMBL1159657 BULLATACIN IC50 = 0.51 nM 9.29
CHEMBL41177 SQUAMOCIN IC50 = 0.59 nM 9.23
CHEMBL142918 rolliniastatin-1 IC50 = 0.6 nM 9.22
CHEMBL357666 IC50 = 0.65 nM 9.19
CHEMBL359434 IC50 = 0.74 nM 9.13
CHEMBL145455 IC50 = 0.95 nM 9.02
CHEMBL145485 IC50 = 1.46 nM 8.84
CHEMBL145624 GUANACONE IC50 = 1.52 nM 8.82
CHEMBL145484 IC50 = 1.65 nM 8.78
CHEMBL145555 IC50 = 1.68 nM 8.78
CHEMBL357600 IC50 = 2.1 nM 8.68
CHEMBL145064 IC50 = 2.9 nM 8.54
CHEMBL145563 IC50 = 5.0 nM 8.30
CHEMBL145073 IC50 = 14.1 nM 7.85
CHEMBL344296 IC50 = 18.0 nM 7.75