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Assay Detail

CHEMBL3077583

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Functional
Antitubercular activity against Mycobacterium tuberculosis H37Rv by BACTEC method
ChEMBL ↗
50
Total Activities
25
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Functional
Organism Mycobacterium tuberculosis
Confidence 1 — Organism
Curated By Autocuration

Target

Mycobacterium tuberculosis (CHEMBL360) ↗
Type ORGANISM
Organism Mycobacterium tuberculosis

Publication

QSAR studies of 7-methyljuglone derivatives as antitubercular agents
Sharma R, Panigrahi D, Mishra GP
Med Chem Res (2012) 21 : 2006 -2011
· DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 50 8.10 8.92

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL43612 JUGLONE — 2 8.92
CHEMBL238592 5-CHLORO-8-HYDROXY-6-METHYLNAPHTHALENE-1,4-DIONE — 2 8.60
CHEMBL440047 — — 2 8.51
CHEMBL239662 — — 2 8.51
CHEMBL2282516 — — 2 8.48
CHEMBL238593 5-BROMO-8-HYDROXY-6-METHYLNAPHTHALENE-1,4-DIONE — 2 8.44
CHEMBL2282513 — — 2 8.41
CHEMBL239661 8-CHLORO-5-HYDROXY-6-METHYLNAPHTHALENE-1,4-DIONE — 2 8.34
CHEMBL239879 — — 2 8.24
CHEMBL239663 — — 2 8.22
CHEMBL241372 — — 2 8.20
CHEMBL239878 — — 2 8.20
CHEMBL241784 5-FLUORO-8-HYDROXY-6-METHYLNAPHTHALENE-1,4-DIONE — 2 8.12
CHEMBL2282512 — — 2 8.11
CHEMBL241163 — — 2 8.11
CHEMBL392193 — — 2 8.10
CHEMBL2282514 — — 2 8.10
CHEMBL2282515 — — 2 7.91
CHEMBL241243 — — 2 7.90
CHEMBL430853 RAMENTACEONE — 2 7.82
CHEMBL241583 — — 2 7.76
CHEMBL394988 — — 2 7.68
CHEMBL393465 — — 2 7.56
CHEMBL241373 — — 2 7.44
CHEMBL240312 — — 2 6.83

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL43612 JUGLONE IC50 = 1.2 nM 8.92
CHEMBL238592 5-CHLORO-8-HYDROXY-6-METHYLNAPHTHALENE-1,4-DIONE IC50 = 2.5 nM 8.60
CHEMBL440047 — IC50 = 3.1 nM 8.51
CHEMBL239662 — IC50 = 3.1 nM 8.51
CHEMBL2282516 — IC50 = 3.3 nM 8.48
CHEMBL238593 5-BROMO-8-HYDROXY-6-METHYLNAPHTHALENE-1,4-DIONE IC50 = 3.6 nM 8.44
CHEMBL2282513 — IC50 = 3.9 nM 8.41
CHEMBL239661 8-CHLORO-5-HYDROXY-6-METHYLNAPHTHALENE-1,4-DIONE IC50 = 4.6 nM 8.34
CHEMBL239879 — IC50 = 5.8 nM 8.24
CHEMBL239663 — IC50 = 6.0 nM 8.22
CHEMBL241372 — IC50 = 6.3 nM 8.20
CHEMBL239878 — IC50 = 6.3 nM 8.20
CHEMBL241784 5-FLUORO-8-HYDROXY-6-METHYLNAPHTHALENE-1,4-DIONE IC50 = 7.6 nM 8.12
CHEMBL2282512 — IC50 = 7.7 nM 8.11
CHEMBL241163 — IC50 = 7.7 nM 8.11
CHEMBL2282514 — IC50 = 7.9 nM 8.10
CHEMBL392193 — IC50 = 8.0 nM 8.10
CHEMBL2282515 — IC50 = 12.4 nM 7.91
CHEMBL241243 — IC50 = 12.5 nM 7.90
CHEMBL430853 RAMENTACEONE IC50 = 15.1 nM 7.82
CHEMBL241583 — IC50 = 17.2 nM 7.76
CHEMBL394988 — IC50 = 21.1 nM 7.68
CHEMBL393465 — IC50 = 27.8 nM 7.56
CHEMBL241373 — IC50 = 36.1 nM 7.44
CHEMBL240312 — IC50 = 149.4 nM 6.83
CHEMBL394988 — IC50 = 47402363.9 nM -
CHEMBL239878 — IC50 = 158744979.83 nM -
CHEMBL440047 — IC50 = 322626472.71 nM -
CHEMBL239662 — IC50 = 322626472.71 nM -
CHEMBL430853 RAMENTACEONE IC50 = 66236900.22 nM -
CHEMBL239661 8-CHLORO-5-HYDROXY-6-METHYLNAPHTHALENE-1,4-DIONE IC50 = 217420254.62 nM -
CHEMBL238593 5-BROMO-8-HYDROXY-6-METHYLNAPHTHALENE-1,4-DIONE IC50 = 277779377.29 nM -
CHEMBL238592 5-CHLORO-8-HYDROXY-6-METHYLNAPHTHALENE-1,4-DIONE IC50 = 400036851.05 nM -
CHEMBL241784 5-FLUORO-8-HYDROXY-6-METHYLNAPHTHALENE-1,4-DIONE IC50 = 131583065.51 nM -
CHEMBL43612 JUGLONE IC50 = 833489244.53 nM -
CHEMBL2282513 — IC50 = 259179113.46 nM -
CHEMBL240312 — IC50 = 6694220.29 nM -
CHEMBL239879 — IC50 = 172424906.83 nM -
CHEMBL241163 — IC50 = 129897262.89 nM -
CHEMBL392193 — IC50 = 125025903.02 nM -
CHEMBL241372 — IC50 = 158744979.83 nM -
CHEMBL241373 — IC50 = 27701290.39 nM -
CHEMBL241243 — IC50 = 80001844.49 nM -
CHEMBL241583 — IC50 = 58143343.23 nM -
CHEMBL239663 — IC50 = 166686335.89 nM -
CHEMBL2282512 — IC50 = 129897262.89 nM -
CHEMBL393465 — IC50 = 35974933.52 nM -
CHEMBL2282516 — IC50 = 299847201.58 nM -
CHEMBL2282515 — IC50 = 81940762.32 nM -
CHEMBL2282514 — IC50 = 125545167.37 nM -