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Assay Detail

CHEMBL828588

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

Binding
Inhibitory concentration against Enterococcus faecalis beta-Ketoacyl-acyl carrier protein synthase III
46
Total Activities
46
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Enterococcus faecalis
Confidence 8 — Homologous single protein target
Curated By Expert

Target

Beta-ketoacyl-[acyl-carrier-protein] synthase III (CHEMBL5070)
Type SINGLE PROTEIN
Organism Enterococcus faecalis (strain ATCC 700802 / V583)

Publication

Structure-based design, synthesis, and study of potent inhibitors of beta-ketoacyl-acyl carrier protein synthase III as potential antimicrobial agents.
Nie Z, Perretta C, Lu J, Su Y, Margosiak S, Gajiwala KS, Cortez J, Nikulin V, Yager KM, Appelt K, Chu S.
J Med Chem (2005) 48 : 1596 -1609
PubMed 15743201 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 46 5.96 8.40

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL370931 1 8.40
CHEMBL180466 1 7.55
CHEMBL175848 1 7.25
CHEMBL191827 1 7.21
CHEMBL179596 1 7.02
CHEMBL179595 1 6.96
CHEMBL195658 1 6.80
CHEMBL180271 1 6.80
CHEMBL179573 1 6.66
CHEMBL369324 1 6.62
CHEMBL359673 1 6.60
CHEMBL361554 1 6.57
CHEMBL179235 1 6.54
CHEMBL426597 1 6.48
CHEMBL193840 1 6.39
CHEMBL178754 1 6.39
CHEMBL179678 1 6.33
CHEMBL179541 1 6.24
CHEMBL179912 1 6.10
CHEMBL178585 1 5.96
CHEMBL180228 1 5.92
CHEMBL175611 1 5.80
CHEMBL178657 1 5.80
CHEMBL362422 1 5.68
CHEMBL180277 1 5.68
CHEMBL178623 1 5.66
CHEMBL178465 1 5.57
CHEMBL179454 1 5.50
CHEMBL434177 1 5.43
CHEMBL180428 1 5.42

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL370931 IC50 = 4.0 nM 8.40
CHEMBL180466 IC50 = 28.0 nM 7.55
CHEMBL175848 IC50 = 56.0 nM 7.25
CHEMBL191827 IC50 = 62.0 nM 7.21
CHEMBL179596 IC50 = 96.0 nM 7.02
CHEMBL179595 IC50 = 110.0 nM 6.96
CHEMBL195658 IC50 = 160.0 nM 6.80
CHEMBL180271 IC50 = 160.0 nM 6.80
CHEMBL179573 IC50 = 220.0 nM 6.66
CHEMBL369324 IC50 = 240.0 nM 6.62
CHEMBL359673 IC50 = 250.0 nM 6.60
CHEMBL361554 IC50 = 270.0 nM 6.57
CHEMBL179235 IC50 = 290.0 nM 6.54
CHEMBL426597 IC50 = 330.0 nM 6.48
CHEMBL178754 IC50 = 410.0 nM 6.39
CHEMBL193840 IC50 = 410.0 nM 6.39
CHEMBL179678 IC50 = 470.0 nM 6.33
CHEMBL179541 IC50 = 570.0 nM 6.24
CHEMBL179912 IC50 = 790.0 nM 6.10
CHEMBL178585 IC50 = 1100.0 nM 5.96
CHEMBL180228 IC50 = 1200.0 nM 5.92
CHEMBL175611 IC50 = 1600.0 nM 5.80
CHEMBL178657 IC50 = 1600.0 nM 5.80
CHEMBL362422 IC50 = 2100.0 nM 5.68
CHEMBL180277 IC50 = 2100.0 nM 5.68
CHEMBL178623 IC50 = 2200.0 nM 5.66
CHEMBL178465 IC50 = 2700.0 nM 5.57
CHEMBL179454 IC50 = 3200.0 nM 5.50
CHEMBL434177 IC50 = 3700.0 nM 5.43
CHEMBL180428 IC50 = 3800.0 nM 5.42
CHEMBL193374 IC50 = 4400.0 nM 5.36
CHEMBL191960 IC50 = 5000.0 nM 5.30
CHEMBL426645 IC50 = 6000.0 nM 5.22
CHEMBL178739 IC50 = 6100.0 nM 5.21
CHEMBL178382 IC50 = 8400.0 nM 5.08
CHEMBL179033 IC50 = 10100.0 nM 5.00
CHEMBL438975 IC50 = 10000.0 nM 5.00
CHEMBL180162 IC50 = 11400.0 nM 4.94
CHEMBL178517 IC50 = 22000.0 nM 4.66
CHEMBL179049 IC50 = 25000.0 nM 4.60
CHEMBL180223 IC50 = 38000.0 nM 4.42
CHEMBL179418 IC50 = 43000.0 nM 4.37
CHEMBL193491 IC50 > 1000000.0 nM -
CHEMBL361610 IC50 = 160000.0 nM -
CHEMBL179402 IC50 = 290000.0 nM -
CHEMBL178832 IC50 = 185000.0 nM -