Assay Detail
Binding
CHEMBL3096566
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Binding affinity to Escherichia coli J96 FimH lectin domain (Phe1 to Thr158) expressed in Escherichia coli C43 (DE3) by isothermal titration calorimetry assay
7
Total Activities
7
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Escherichia coli J96 |
| Confidence | 0 — Uncurated / Unknown |
| Curated By | Autocuration |
Publication
Validation of Reactivity Descriptors to Assess the Aromatic Stacking within the Tyrosine Gate of FimH.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Kd | 7 | 7.35 | 8.14 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL1170455 | — | — | 1 | 8.14 |
| CHEMBL3092402 | — | — | 1 | 7.74 |
| CHEMBL3092403 | — | — | 1 | 7.22 |
| CHEMBL3092401 | — | — | 1 | 7.22 |
| CHEMBL3092409 | — | — | 1 | 6.98 |
| CHEMBL1170454 | BUTYLALPHAMAN | — | 1 | 6.81 |
| CHEMBL3092243 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL1170455 | — | Kd | = | 7.3 | nM | 8.14 |
| CHEMBL3092402 | — | Kd | = | 18.3 | nM | 7.74 |
| CHEMBL3092403 | — | Kd | = | 59.5 | nM | 7.22 |
| CHEMBL3092401 | — | Kd | = | 59.5 | nM | 7.22 |
| CHEMBL3092409 | — | Kd | = | 104.6 | nM | 6.98 |
| CHEMBL1170454 | BUTYLALPHAMAN | Kd | = | 153.6 | nM | 6.81 |
| CHEMBL3092243 | — | Kd | - | — | - |