Assay Detail
Binding
CHEMBL4880039
Review assay metadata, readout intent, target linkage, and publication context from the same page.
GPCRScan assay: inhibition of SERT
199
Total Activities
181
Compounds Tested
2
Activity Types
12
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Homo sapiens |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Target
Sodium-dependent serotonin transporter (CHEMBL228) ↗| Type | SINGLE PROTEIN |
| Organism | Homo sapiens |
Publication
SGC PDSP GPCRScan assays
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Inhibition | 183 | - | - |
| Ki | 16 | 6.07 | 7.62 |
Assay Parameters
| Parameter | Type | Value | Units | Text |
|---|---|---|---|---|
| Parental cells | Parental cells | - | — | stable HEK |
| PMID | PMID | - | — | 3475452/20036748 |
| Protein length | Protein length | - | — | full-length |
| Radioligand conc. used [nM] | Radioligand conc. used [nM] | - | — | 1.5 – 2.0 |
| Radioligand Kd | Radioligand Kd | 2.63 | nM | — |
| Radioligand name | Radioligand name | - | — | [3H]-Citalopram |
| Radioligand pKd | Radioligand pKd | 8.58 | — | — |
| Radioligand pKd ± SEM | Radioligand pKd ± SEM | 0.11 | — | — |
| Reference ligand | Reference ligand | - | — | Amitriptyline |
| Reference ligand Ki | Reference ligand Ki | 5.53 | nM | — |
| Reference ligand pKi | Reference ligand pKi | 8.26 | — | — |
| Reference ligand pKi ± SEM | Reference ligand pKi ± SEM | 0.02 | — | — |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL3609749 | — | — | 3 | 7.62 |
| CHEMBL4282264 | A-485 | — | 3 | 6.66 |
| CHEMBL4752561 | — | — | 3 | 6.42 |
| CHEMBL3337895 | T-26f | — | 3 | 6.10 |
| CHEMBL4647642 | BAY-173 | — | 3 | 5.84 |
| CHEMBL4802044 | JNJ-73924149 | — | 3 | 5.59 |
| CHEMBL4520788 | BAY-294 | — | 3 | 5.37 |
| CHEMBL3589752 | IPP/CNRS-A017 | — | 3 | 5.00 |
| CHEMBL4585243 | BAY-7598 | — | 1 | - |
| CHEMBL4630644 | BAY-386 | — | 1 | - |
| CHEMBL4539943 | BAY-694 | — | 1 | - |
| CHEMBL4521594 | BAY-1797 | — | 1 | - |
| CHEMBL4516843 | BAY-207 | — | 1 | - |
| CHEMBL4537788 | BAY-784 | — | 1 | - |
| CHEMBL4564312 | BAY-786 | — | 1 | - |
| CHEMBL4448899 | BAY-876 | — | 1 | - |
| CHEMBL4552180 | BAY-588 | — | 1 | - |
| CHEMBL4445670 | BAY-885 | — | 1 | - |
| CHEMBL4455582 | BAY-693 | — | 1 | - |
| CHEMBL4522773 | BAY-827 | — | 1 | - |
| CHEMBL4593677 | BAY-474 | — | 1 | - |
| CHEMBL4066040 | A-1596584 | — | 1 | - |
| CHEMBL4093612 | A-1596586 | — | 1 | - |
| CHEMBL332794 | A-192621 | — | 1 | - |
| CHEMBL4513786 | A-545 | — | 1 | - |
| CHEMBL111612 | ABT-546 | — | 1 | - |
| CHEMBL4526341 | A-108 | — | 1 | - |
| CHEMBL4586794 | ABT-100 | — | 1 | - |
| CHEMBL3701197 | A-226 | — | 1 | - |
| CHEMBL3697701 | A-079 | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL3609749 | — | Ki | = | 24.0 | nM | 7.62 |
| CHEMBL3609749 | — | Ki | = | 25.12 | nM | 7.60 |
| CHEMBL4282264 | A-485 | Ki | = | 218.78 | nM | 6.66 |
| CHEMBL4282264 | A-485 | Ki | = | 223.27 | nM | 6.65 |
| CHEMBL4752561 | — | Ki | = | 380.19 | nM | 6.42 |
| CHEMBL4752561 | — | Ki | = | 390.58 | nM | 6.41 |
| CHEMBL3337895 | T-26f | Ki | = | 794.33 | nM | 6.10 |
| CHEMBL3337895 | T-26f | Ki | = | 831.0 | nM | 6.08 |
| CHEMBL4647642 | BAY-173 | Ki | = | 1445.44 | nM | 5.84 |
| CHEMBL4647642 | BAY-173 | Ki | = | 1460.83 | nM | 5.83 |
| CHEMBL4802044 | JNJ-73924149 | Ki | = | 2570.4 | nM | 5.59 |
| CHEMBL4802044 | JNJ-73924149 | Ki | = | 2614.09 | nM | 5.58 |
| CHEMBL4520788 | BAY-294 | Ki | = | 4265.8 | nM | 5.37 |
| CHEMBL4520788 | BAY-294 | Ki | = | 4231.56 | nM | 5.37 |
| CHEMBL3589752 | IPP/CNRS-A017 | Ki | = | 10000.0 | nM | 5.00 |
| CHEMBL3589752 | IPP/CNRS-A017 | Ki | = | 10000.0 | nM | 5.00 |
| CHEMBL4549667 | TP-030-2 | Inhibition | = | 22.64 | % | - |
| CHEMBL4592872 | BAY-897 | Inhibition | = | 21.08 | % | - |
| CHEMBL4537673 | BAY-985 | Inhibition | = | 21.55 | % | - |
| CHEMBL4538591 | BAY-440 | Inhibition | = | 9.9 | % | - |
| CHEMBL4580220 | BAY-3827 | Inhibition | = | -6.24 | % | - |
| CHEMBL4630642 | BAY-974 | Inhibition | = | -6.29 | % | - |
| CHEMBL4456585 | WM-1119 | Inhibition | = | -16.72 | % | - |
| CHEMBL4520293 | (R)-ZINC-3573 | Inhibition | = | 4.09 | % | - |
| CHEMBL4534980 | (S)-ZINC-3573 | Inhibition | = | 2.83 | % | - |
| CHEMBL4460070 | ZINC32547799 | Inhibition | = | 9.44 | % | - |
| CHEMBL4088216 | TP-030-1 | Inhibition | = | 5.99 | % | - |
| CHEMBL4635134 | GSK620 | Inhibition | = | -15.93 | % | - |
| CHEMBL4635540 | GSK791 | Inhibition | = | 13.85 | % | - |
| CHEMBL4636881 | GSK046 | Inhibition | = | -10.05 | % | - |
| CHEMBL4648362 | GSK789 | Inhibition | = | 17.7 | % | - |
| CHEMBL4638406 | BAY-3153 | Inhibition | = | 33.43 | % | - |
| CHEMBL4568735 | NVS-MALT1 | Inhibition | = | 11.32 | % | - |
| CHEMBL4637208 | GSK973 | Inhibition | = | 27.25 | % | - |
| CHEMBL4647642 | BAY-173 | Inhibition | = | 70.26 | % | - |
| CHEMBL4577237 | BI 9446 | Inhibition | = | 5.35 | % | - |
| CHEMBL4530740 | BI 1950 | Inhibition | = | -4.33 | % | - |
| CHEMBL4552554 | PF-04475866 | Inhibition | = | -6.29 | % | - |
| CHEMBL3286797 | PF-04418948 | Inhibition | = | -6.83 | % | - |
| CHEMBL2204283 | MSD-M1PAM-NC | Inhibition | = | -12.04 | % | - |
| CHEMBL1800285 | MSD-M1PAM | Inhibition | = | 19.01 | % | - |
| CHEMBL4638939 | GSK943 | Inhibition | = | -14.21 | % | - |
| CHEMBL4063249 | TP-021n | Inhibition | = | 21.12 | % | - |
| CHEMBL4639128 | GSK778 | Inhibition | = | 10.71 | % | - |
| CHEMBL4545807 | BAY-070 | Inhibition | = | 7.08 | % | - |
| CHEMBL4798829 | — | Inhibition | = | 40.26 | % | - |
| CHEMBL4536197 | A-486 | Inhibition | = | 31.03 | % | - |
| CHEMBL4282264 | A-485 | Inhibition | = | 95.58 | % | - |
| CHEMBL4561806 | BTZO-4 | Inhibition | = | -11.21 | % | - |
| CHEMBL4516611 | BTZO-1 | Inhibition | = | -10.2 | % | - |