Assay Detail
Binding
CHEMBL995198
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Inhibition of serotonin uptake at human SERT expressed in HEK cells
41
Total Activities
41
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Homo sapiens |
| Cell Type | HEK293 |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Target
Sodium-dependent serotonin transporter (CHEMBL228) ↗| Type | SINGLE PROTEIN |
| Organism | Homo sapiens |
Publication
Synthesis and structure-activity relationships of selective norepinephrine reuptake inhibitors (sNRI) with a heterocyclic ring constraint.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 41 | 5.85 | 7.33 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL41 | FLUOXETINE | 4.0 | 1 | 7.33 |
| CHEMBL526306 | — | — | 1 | 7.05 |
| CHEMBL497679 | — | — | 1 | 7.00 |
| CHEMBL524271 | — | — | 1 | 6.85 |
| CHEMBL497680 | — | — | 1 | 6.82 |
| CHEMBL641 | ATOMOXETINE | 4.0 | 1 | 6.75 |
| CHEMBL497666 | — | — | 1 | 6.72 |
| CHEMBL497664 | — | — | 1 | 6.64 |
| CHEMBL497492 | — | — | 1 | 6.19 |
| CHEMBL526669 | — | — | 1 | 5.96 |
| CHEMBL451105 | — | — | 1 | 5.96 |
| CHEMBL444742 | — | — | 1 | 5.96 |
| CHEMBL498495 | — | — | 1 | 5.92 |
| CHEMBL445082 | — | — | 1 | 5.85 |
| CHEMBL526825 | — | — | 1 | 5.85 |
| CHEMBL295467 | NISOXETINE | 2.0 | 1 | 5.85 |
| CHEMBL497665 | — | — | 1 | 5.82 |
| CHEMBL455447 | — | — | 1 | 5.80 |
| CHEMBL448375 | — | — | 1 | 5.75 |
| CHEMBL505433 | — | — | 1 | 5.60 |
| CHEMBL525375 | — | — | 1 | 5.58 |
| CHEMBL498686 | — | — | 1 | 5.57 |
| CHEMBL498680 | — | — | 1 | 5.57 |
| CHEMBL522065 | — | — | 1 | 5.52 |
| CHEMBL523574 | — | — | 1 | 5.51 |
| CHEMBL526670 | — | — | 1 | 5.51 |
| CHEMBL497846 | — | — | 1 | 5.51 |
| CHEMBL497512 | — | — | 1 | 5.50 |
| CHEMBL496284 | — | — | 1 | 5.46 |
| CHEMBL498510 | — | — | 1 | 5.44 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL41 | FLUOXETINE | IC50 | = | 47.0 | nM | 7.33 |
| CHEMBL526306 | — | IC50 | = | 90.0 | nM | 7.05 |
| CHEMBL497679 | — | IC50 | = | 100.0 | nM | 7.00 |
| CHEMBL524271 | — | IC50 | = | 140.0 | nM | 6.85 |
| CHEMBL497680 | — | IC50 | = | 150.0 | nM | 6.82 |
| CHEMBL641 | ATOMOXETINE | IC50 | = | 180.0 | nM | 6.75 |
| CHEMBL497666 | — | IC50 | = | 190.0 | nM | 6.72 |
| CHEMBL497664 | — | IC50 | = | 230.0 | nM | 6.64 |
| CHEMBL497492 | — | IC50 | = | 640.0 | nM | 6.19 |
| CHEMBL444742 | — | IC50 | = | 1100.0 | nM | 5.96 |
| CHEMBL451105 | — | IC50 | = | 1100.0 | nM | 5.96 |
| CHEMBL526669 | — | IC50 | = | 1100.0 | nM | 5.96 |
| CHEMBL498495 | — | IC50 | = | 1200.0 | nM | 5.92 |
| CHEMBL295467 | NISOXETINE | IC50 | = | 1400.0 | nM | 5.85 |
| CHEMBL526825 | — | IC50 | = | 1400.0 | nM | 5.85 |
| CHEMBL445082 | — | IC50 | = | 1400.0 | nM | 5.85 |
| CHEMBL497665 | — | IC50 | = | 1500.0 | nM | 5.82 |
| CHEMBL455447 | — | IC50 | = | 1600.0 | nM | 5.80 |
| CHEMBL448375 | — | IC50 | = | 1800.0 | nM | 5.75 |
| CHEMBL505433 | — | IC50 | = | 2500.0 | nM | 5.60 |
| CHEMBL525375 | — | IC50 | = | 2600.0 | nM | 5.58 |
| CHEMBL498680 | — | IC50 | = | 2700.0 | nM | 5.57 |
| CHEMBL498686 | — | IC50 | = | 2700.0 | nM | 5.57 |
| CHEMBL522065 | — | IC50 | = | 3000.0 | nM | 5.52 |
| CHEMBL523574 | — | IC50 | = | 3100.0 | nM | 5.51 |
| CHEMBL526670 | — | IC50 | = | 3100.0 | nM | 5.51 |
| CHEMBL497846 | — | IC50 | = | 3100.0 | nM | 5.51 |
| CHEMBL497512 | — | IC50 | = | 3200.0 | nM | 5.50 |
| CHEMBL496284 | — | IC50 | = | 3500.0 | nM | 5.46 |
| CHEMBL498510 | — | IC50 | = | 3600.0 | nM | 5.44 |
| CHEMBL498509 | — | IC50 | = | 3800.0 | nM | 5.42 |
| CHEMBL497845 | — | IC50 | = | 4000.0 | nM | 5.40 |
| CHEMBL498687 | — | IC50 | = | 4500.0 | nM | 5.35 |
| CHEMBL526270 | — | IC50 | = | 5600.0 | nM | 5.25 |
| CHEMBL524798 | — | IC50 | = | 6000.0 | nM | 5.22 |
| CHEMBL497479 | — | IC50 | = | 6000.0 | nM | 5.22 |
| CHEMBL497493 | — | IC50 | = | 6000.0 | nM | 5.22 |
| CHEMBL505902 | — | IC50 | = | 6500.0 | nM | 5.19 |
| CHEMBL505439 | — | IC50 | = | 10000.0 | nM | 5.00 |
| CHEMBL524624 | — | IC50 | > | 10000.0 | nM | - |
| CHEMBL496285 | — | IC50 | > | 10000.0 | nM | - |