Assay Detail
Binding
CHEMBL4880041
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GPCRScan assay: inhibition of DAT
261
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 dopamine transporter (CHEMBL238) ↗| Type | SINGLE PROTEIN |
| Organism | Homo sapiens |
Publication
SGC PDSP GPCRScan assays
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Inhibition | 181 | - | - |
| Ki | 80 | 5.61 | 6.72 |
Assay Parameters
| Parameter | Type | Value | Units | Text |
|---|---|---|---|---|
| Parental cells | Parental cells | - | — | stable HEK |
| PMID | PMID | - | — | 20688912/9021897 |
| Protein length | Protein length | - | — | full-length |
| Radioligand conc. used [nM] | Radioligand conc. used [nM] | - | — | 3.6 – 16.0 |
| Radioligand Kd | Radioligand Kd | 9.47 | nM | — |
| Radioligand name | Radioligand name | - | — | [3H]-Win35428 |
| Radioligand pKd | Radioligand pKd | 8.02 | — | — |
| Radioligand pKd ± SEM | Radioligand pKd ± SEM | 0.04 | — | — |
| Reference ligand | Reference ligand | - | — | GBR12909 |
| Reference ligand Ki | Reference ligand Ki | 4.73 | nM | — |
| Reference ligand pKi | Reference ligand pKi | 8.33 | — | — |
| Reference ligand pKi ± SEM | Reference ligand pKi ± SEM | 0.02 | — | — |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL3609749 | — | — | 3 | 6.72 |
| CHEMBL561132 | MK-7246 | 1.0 | 3 | 6.55 |
| CHEMBL4535474 | BAY-293 | — | 3 | 6.32 |
| CHEMBL4578164 | MRL-CB1-NC | — | 3 | 6.12 |
| CHEMBL4560241 | BI 0153 | — | 3 | 6.10 |
| CHEMBL4540759 | BI 0054 | — | 3 | 6.10 |
| CHEMBL4748908 | TP-040n | — | 3 | 6.08 |
| CHEMBL4520293 | (R)-ZINC-3573 | — | 3 | 5.96 |
| CHEMBL4514203 | BAY-390 | — | 3 | 5.87 |
| CHEMBL4520788 | BAY-294 | — | 3 | 5.85 |
| CHEMBL2170610 | BI 9627 | — | 3 | 5.82 |
| CHEMBL3799512 | TP-004 | — | 3 | 5.80 |
| CHEMBL3480577 | UCSF924 | — | 3 | 5.79 |
| CHEMBL5082184 | — | — | 3 | 5.79 |
| CHEMBL4282264 | A-485 | — | 3 | 5.75 |
| CHEMBL5086970 | — | — | 3 | 5.66 |
| CHEMBL1091513 | MRK-560 | — | 3 | 5.50 |
| CHEMBL4795065 | Borussertib | — | 3 | 5.44 |
| CHEMBL5027912 | — | — | 3 | 5.38 |
| CHEMBL4802037 | BI-5026 | — | 3 | 5.37 |
| CHEMBL4516982 | BI 1935 | — | 3 | 5.35 |
| CHEMBL4445645 | — | — | 3 | 5.31 |
| CHEMBL4802044 | JNJ-73924149 | — | 3 | 5.28 |
| CHEMBL5092747 | — | — | 3 | 5.18 |
| CHEMBL5087167 | — | — | 3 | 5.14 |
| CHEMBL4802046 | MSC-0516 | — | 3 | 5.02 |
| CHEMBL5092058 | — | — | 3 | 5.02 |
| CHEMBL4551344 | A-1210227 | — | 3 | 5.01 |
| CHEMBL4530401 | MRL-SYKi-NC | — | 3 | 5.00 |
| CHEMBL4558518 | GSI-NC | — | 3 | 5.00 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL3609749 | — | Ki | = | 191.0 | nM | 6.72 |
| CHEMBL3609749 | — | Ki | = | 199.53 | nM | 6.70 |
| CHEMBL561132 | MK-7246 | Ki | = | 283.0 | nM | 6.55 |
| CHEMBL561132 | MK-7246 | Ki | = | 316.23 | nM | 6.50 |
| CHEMBL4535474 | BAY-293 | Ki | = | 478.63 | nM | 6.32 |
| CHEMBL4535474 | BAY-293 | Ki | = | 522.03 | nM | 6.28 |
| CHEMBL4578164 | MRL-CB1-NC | Ki | = | 766.0 | nM | 6.12 |
| CHEMBL4578164 | MRL-CB1-NC | Ki | = | 794.33 | nM | 6.10 |
| CHEMBL4540759 | BI 0054 | Ki | = | 794.33 | nM | 6.10 |
| CHEMBL4560241 | BI 0153 | Ki | = | 794.33 | nM | 6.10 |
| CHEMBL4748908 | TP-040n | Ki | = | 831.76 | nM | 6.08 |
| CHEMBL4540759 | BI 0054 | Ki | = | 825.0 | nM | 6.08 |
| CHEMBL4560241 | BI 0153 | Ki | = | 855.0 | nM | 6.07 |
| CHEMBL4748908 | TP-040n | Ki | = | 864.98 | nM | 6.06 |
| CHEMBL4520293 | (R)-ZINC-3573 | Ki | = | 1096.48 | nM | 5.96 |
| CHEMBL4520293 | (R)-ZINC-3573 | Ki | = | 1109.25 | nM | 5.96 |
| CHEMBL4514203 | BAY-390 | Ki | = | 1348.96 | nM | 5.87 |
| CHEMBL4514203 | BAY-390 | Ki | = | 1377.15 | nM | 5.86 |
| CHEMBL4520788 | BAY-294 | Ki | = | 1412.54 | nM | 5.85 |
| CHEMBL2170610 | BI 9627 | Ki | = | 1523.0 | nM | 5.82 |
| CHEMBL3799512 | TP-004 | Ki | = | 1584.89 | nM | 5.80 |
| CHEMBL2170610 | BI 9627 | Ki | = | 1584.89 | nM | 5.80 |
| CHEMBL3480577 | UCSF924 | Ki | = | 1621.81 | nM | 5.79 |
| CHEMBL5082184 | — | Ki | = | 1621.81 | nM | 5.79 |
| CHEMBL5082184 | — | Ki | = | 1626.67 | nM | 5.79 |
| CHEMBL3799512 | TP-004 | Ki | = | 1679.0 | nM | 5.78 |
| CHEMBL4520788 | BAY-294 | Ki | = | 1672.13 | nM | 5.78 |
| CHEMBL4282264 | A-485 | Ki | = | 1778.28 | nM | 5.75 |
| CHEMBL4282264 | A-485 | Ki | = | 1817.04 | nM | 5.74 |
| CHEMBL3480577 | UCSF924 | Ki | = | 2116.67 | nM | 5.67 |
| CHEMBL5086970 | — | Ki | = | 2175.7 | nM | 5.66 |
| CHEMBL5086970 | — | Ki | = | 2187.76 | nM | 5.66 |
| CHEMBL1091513 | MRK-560 | Ki | = | 3162.28 | nM | 5.50 |
| CHEMBL1091513 | MRK-560 | Ki | = | 3137.0 | nM | 5.50 |
| CHEMBL4795065 | Borussertib | Ki | = | 3655.95 | nM | 5.44 |
| CHEMBL4795065 | Borussertib | Ki | = | 3630.78 | nM | 5.44 |
| CHEMBL5027912 | — | Ki | = | 4168.69 | nM | 5.38 |
| CHEMBL5027912 | — | Ki | = | 4132.38 | nM | 5.38 |
| CHEMBL4802037 | BI-5026 | Ki | = | 4270.71 | nM | 5.37 |
| CHEMBL4802037 | BI-5026 | Ki | = | 4265.8 | nM | 5.37 |
| CHEMBL4516982 | BI 1935 | Ki | = | 4477.0 | nM | 5.35 |
| CHEMBL4445645 | — | Ki | = | 4897.79 | nM | 5.31 |
| CHEMBL4516982 | BI 1935 | Ki | = | 5011.87 | nM | 5.30 |
| CHEMBL4445645 | — | Ki | = | 5087.69 | nM | 5.29 |
| CHEMBL4802044 | JNJ-73924149 | Ki | = | 5248.07 | nM | 5.28 |
| CHEMBL4802044 | JNJ-73924149 | Ki | = | 5284.45 | nM | 5.28 |
| CHEMBL5092747 | — | Ki | = | 6606.93 | nM | 5.18 |
| CHEMBL5092747 | — | Ki | = | 6549.38 | nM | 5.18 |
| CHEMBL5087167 | — | Ki | = | 7244.36 | nM | 5.14 |
| CHEMBL5087167 | — | Ki | = | 7216.06 | nM | 5.14 |