Assay Detail
Binding
CHEMBL868082
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Binding affinity to human PNMT expressed in Escherichia coli by radiochemical assay
27
Total Activities
27
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Homo sapiens |
| Confidence | 9 — Direct single protein target |
| Curated By | Expert |
Target
Phenylethanolamine N-methyltransferase (CHEMBL4617) ↗| Type | SINGLE PROTEIN |
| Organism | Homo sapiens |
Publication
Comparison of the binding of 3-fluoromethyl-7-sulfonyl-1,2,3,4-tetrahydroisoquinolines with their isosteric sulfonamides to the active site of phenylethanolamine N-methyltransferase.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Ki | 27 | 5.87 | 8.51 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL287837 | — | — | 1 | 8.51 |
| CHEMBL366785 | — | — | 1 | 7.64 |
| CHEMBL41647 | — | — | 1 | 7.28 |
| CHEMBL176112 | — | — | 1 | 7.20 |
| CHEMBL178695 | — | — | 1 | 6.89 |
| CHEMBL95873 | — | — | 1 | 6.82 |
| CHEMBL177621 | — | — | 1 | 6.66 |
| CHEMBL290890 | — | — | 1 | 6.57 |
| CHEMBL26717 | — | — | 1 | 6.55 |
| CHEMBL27664 | — | — | 1 | 6.10 |
| CHEMBL333578 | — | — | 1 | 5.96 |
| CHEMBL213339 | — | — | 1 | 5.89 |
| CHEMBL177861 | — | — | 1 | 5.85 |
| CHEMBL213031 | — | — | 1 | 5.85 |
| CHEMBL435536 | — | — | 1 | 5.77 |
| CHEMBL212790 | — | — | 1 | 5.62 |
| CHEMBL120975 | — | — | 1 | 5.43 |
| CHEMBL184931 | — | — | 1 | 5.29 |
| CHEMBL14346 | 1,2,3,4-TETRAHYDROISOQUINOLINE | — | 1 | 5.24 |
| CHEMBL27599 | — | — | 1 | 5.20 |
| CHEMBL280592 | — | — | 1 | 5.05 |
| CHEMBL213579 | — | — | 1 | 4.85 |
| CHEMBL215871 | — | — | 1 | 4.75 |
| CHEMBL28431 | — | — | 1 | 4.64 |
| CHEMBL439320 | — | — | 1 | 4.50 |
| CHEMBL214064 | — | — | 1 | 4.17 |
| CHEMBL212026 | — | — | 1 | 4.14 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL287837 | — | Ki | = | 3.1 | nM | 8.51 |
| CHEMBL366785 | — | Ki | = | 23.0 | nM | 7.64 |
| CHEMBL41647 | — | Ki | = | 52.0 | nM | 7.28 |
| CHEMBL176112 | — | Ki | = | 63.0 | nM | 7.20 |
| CHEMBL178695 | — | Ki | = | 130.0 | nM | 6.89 |
| CHEMBL95873 | — | Ki | = | 150.0 | nM | 6.82 |
| CHEMBL177621 | — | Ki | = | 220.0 | nM | 6.66 |
| CHEMBL290890 | — | Ki | = | 270.0 | nM | 6.57 |
| CHEMBL26717 | — | Ki | = | 280.0 | nM | 6.55 |
| CHEMBL27664 | — | Ki | = | 790.0 | nM | 6.10 |
| CHEMBL333578 | — | Ki | = | 1100.0 | nM | 5.96 |
| CHEMBL213339 | — | Ki | = | 1300.0 | nM | 5.89 |
| CHEMBL177861 | — | Ki | = | 1400.0 | nM | 5.85 |
| CHEMBL213031 | — | Ki | = | 1400.0 | nM | 5.85 |
| CHEMBL435536 | — | Ki | = | 1700.0 | nM | 5.77 |
| CHEMBL212790 | — | Ki | = | 2400.0 | nM | 5.62 |
| CHEMBL120975 | — | Ki | = | 3700.0 | nM | 5.43 |
| CHEMBL184931 | — | Ki | = | 5100.0 | nM | 5.29 |
| CHEMBL14346 | 1,2,3,4-TETRAHYDROISOQUINOLINE | Ki | = | 5800.0 | nM | 5.24 |
| CHEMBL27599 | — | Ki | = | 6300.0 | nM | 5.20 |
| CHEMBL280592 | — | Ki | = | 9000.0 | nM | 5.05 |
| CHEMBL213579 | — | Ki | = | 14000.0 | nM | 4.85 |
| CHEMBL215871 | — | Ki | = | 18000.0 | nM | 4.75 |
| CHEMBL28431 | — | Ki | = | 23000.0 | nM | 4.64 |
| CHEMBL439320 | — | Ki | = | 32000.0 | nM | 4.50 |
| CHEMBL214064 | — | Ki | = | 67000.0 | nM | 4.17 |
| CHEMBL212026 | — | Ki | = | 72000.0 | nM | 4.14 |