Assay Detail
Binding
CHEMBL3399322
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Inhibition of Pseudomonas aeruginosa recombinant PqsD expressed in Escherichia coli BL21 (lambdaDE3) using ACoA/beta-ketodecanoic acid as substrate after 10 mins
9
Total Activities
9
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Pseudomonas aeruginosa |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Target
2-heptyl-4(1H)-quinolone synthase PqsD (CHEMBL3559673) ↗| Type | SINGLE PROTEIN |
| Organism | Pseudomonas aeruginosa |
Publication
Catechol-based substrates of chalcone synthase as a scaffold for novel inhibitors of PqsD.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 9 | 4.79 | 5.23 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL3397068 | — | — | 1 | 5.23 |
| CHEMBL3397065 | — | — | 1 | 5.10 |
| CHEMBL3289683 | — | — | 1 | 5.07 |
| CHEMBL3093471 | — | — | 1 | 4.85 |
| CHEMBL3397067 | — | — | 1 | 4.70 |
| CHEMBL3120494 | — | — | 1 | 4.64 |
| CHEMBL3093470 | — | — | 1 | 4.64 |
| CHEMBL136927 | DIHYDROCAFFEIC ACID | — | 1 | 4.57 |
| CHEMBL17001 | METHYLCAFFEATE | — | 1 | 4.29 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL3397068 | — | IC50 | = | 5900.0 | nM | 5.23 |
| CHEMBL3397065 | — | IC50 | = | 7900.0 | nM | 5.10 |
| CHEMBL3289683 | — | IC50 | = | 8600.0 | nM | 5.07 |
| CHEMBL3093471 | — | IC50 | = | 14000.0 | nM | 4.85 |
| CHEMBL3397067 | — | IC50 | = | 20000.0 | nM | 4.70 |
| CHEMBL3120494 | — | IC50 | = | 23000.0 | nM | 4.64 |
| CHEMBL3093470 | — | IC50 | = | 23000.0 | nM | 4.64 |
| CHEMBL136927 | DIHYDROCAFFEIC ACID | IC50 | = | 27000.0 | nM | 4.57 |
| CHEMBL17001 | METHYLCAFFEATE | IC50 | = | 51000.0 | nM | 4.29 |