Assay Detail
Binding
CHEMBL4481769
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Displacement of [3H]CCPA from recombinant human adenosine A1 receptor expressed in CHO cells
18
Total Activities
18
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Homo sapiens |
| Cell Type | CHO |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Publication
Novel multi-target directed ligands based on annelated xanthine scaffold with aromatic substituents acting on adenosine receptor and monoamine oxidase B. Synthesis, in vitro and in silico studies.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Ki | 18 | 5.76 | 6.40 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL4563397 | — | — | 1 | 6.40 |
| CHEMBL4579508 | — | — | 1 | 6.19 |
| CHEMBL431770 | ISTRADEFYLLINE | 4.0 | 1 | 6.08 |
| CHEMBL113 | CAFFEINE | 4.0 | 1 | 4.35 |
| CHEMBL241618 | — | — | 1 | - |
| CHEMBL4521398 | — | — | 1 | - |
| CHEMBL4573517 | — | — | 1 | - |
| CHEMBL4574378 | — | — | 1 | - |
| CHEMBL4573063 | — | — | 1 | - |
| CHEMBL4554404 | — | — | 1 | - |
| CHEMBL4550899 | — | — | 1 | - |
| CHEMBL4530654 | — | — | 1 | - |
| CHEMBL4569183 | — | — | 1 | - |
| CHEMBL4559410 | — | — | 1 | - |
| CHEMBL4544530 | — | — | 1 | - |
| CHEMBL4549927 | — | — | 1 | - |
| CHEMBL4483563 | — | — | 1 | - |
| CHEMBL4517303 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL4563397 | — | Ki | = | 396.0 | nM | 6.40 |
| CHEMBL4579508 | — | Ki | = | 651.0 | nM | 6.19 |
| CHEMBL431770 | ISTRADEFYLLINE | Ki | = | 841.0 | nM | 6.08 |
| CHEMBL113 | CAFFEINE | Ki | = | 44900.0 | nM | 4.35 |
| CHEMBL241618 | — | Ki | > | 10000.0 | nM | - |
| CHEMBL4521398 | — | Ki | > | 1000.0 | nM | - |
| CHEMBL4573517 | — | Ki | > | 1000.0 | nM | - |
| CHEMBL4574378 | — | Ki | > | 1000.0 | nM | - |
| CHEMBL4573063 | — | Ki | > | 1000.0 | nM | - |
| CHEMBL4554404 | — | Ki | > | 1000.0 | nM | - |
| CHEMBL4550899 | — | Ki | > | 1000.0 | nM | - |
| CHEMBL4530654 | — | Ki | > | 1000.0 | nM | - |
| CHEMBL4569183 | — | Ki | > | 1000.0 | nM | - |
| CHEMBL4559410 | — | Ki | > | 1000.0 | nM | - |
| CHEMBL4544530 | — | Ki | > | 1000.0 | nM | - |
| CHEMBL4549927 | — | Ki | > | 1000.0 | nM | - |
| CHEMBL4483563 | — | Ki | > | 1000.0 | nM | - |
| CHEMBL4517303 | — | Ki | > | 1000.0 | nM | - |