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Assay Detail

CHEMBL4407553

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

Binding
Inhibition of recombinant N-terminal His-tagged Pseudomonas aeruginosa PAO1 biotin carboxylase expressed in Escherichia coli Rosetta(DE3) pLysS cells using biotin as substrate by spectroscopic analysis
20
Total Activities
20
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Pseudomonas aeruginosa PAO1
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Biotin carboxylase (CHEMBL4523221)
Type SINGLE PROTEIN
Organism Pseudomonas aeruginosa (strain ATCC 15692 / DSM 22644 / CIP 104116 / JCM14847 / LMG 12228 / 1C / PRS 101 / PAO1)

Publication

Optimization and Mechanistic Characterization of Pyridopyrimidine Inhibitors of Bacterial Biotin Carboxylase.
Andrews LD, Kane TR, Dozzo P, Haglund CM, Hilderbrandt DJ, Linsell MS, Machajewski T, McEnroe G, Serio AW, Wlasichuk KB, Neau DB, Pakhomova S, Waldrop GL, Sharp M, Pogliano J, Cirz RT, Cohen F.
J Med Chem (2019) 62 : 7489 -7505
PubMed 31306011 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 20 6.94 7.50

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4466052 1 7.50
CHEMBL4518489 1 7.48
CHEMBL4530311 1 7.44
CHEMBL4459017 1 7.19
CHEMBL4450292 1 7.10
CHEMBL4563086 1 7.08
CHEMBL4445287 1 7.03
CHEMBL4551132 1 6.89
CHEMBL4564355 1 6.85
CHEMBL4582507 1 6.77
CHEMBL57531 1 6.75
CHEMBL4440951 1 6.72
CHEMBL4464608 1 6.50
CHEMBL58627 1 6.50
CHEMBL4520904 1 6.36
CHEMBL4453148 1 -
CHEMBL4519530 1 -
CHEMBL4470362 1 -
CHEMBL4476532 1 -
CHEMBL4546703 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4466052 IC50 = 32.0 nM 7.50
CHEMBL4518489 IC50 = 33.0 nM 7.48
CHEMBL4530311 IC50 = 36.0 nM 7.44
CHEMBL4459017 IC50 = 64.0 nM 7.19
CHEMBL4450292 IC50 = 79.0 nM 7.10
CHEMBL4563086 IC50 = 83.0 nM 7.08
CHEMBL4445287 IC50 = 93.0 nM 7.03
CHEMBL4551132 IC50 = 130.0 nM 6.89
CHEMBL4564355 IC50 = 140.0 nM 6.85
CHEMBL4582507 IC50 = 170.0 nM 6.77
CHEMBL57531 IC50 = 180.0 nM 6.75
CHEMBL4440951 IC50 = 190.0 nM 6.72
CHEMBL4464608 IC50 = 320.0 nM 6.50
CHEMBL58627 IC50 = 320.0 nM 6.50
CHEMBL4520904 IC50 = 440.0 nM 6.36
CHEMBL4453148 IC50 <= 15.0 nM -
CHEMBL4519530 IC50 <= 15.0 nM -
CHEMBL4470362 IC50 <= 15.0 nM -
CHEMBL4476532 IC50 <= 15.0 nM -
CHEMBL4546703 IC50 <= 15.0 nM -