Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 17/20 | 0.70 |
| ▸ | HTR1A | P08908 | 10/20 | 0.70 |
| ▸ | DRD4 | P21917 | 8/20 | 0.70 |
| ▸ | DRD3 | P35462 | 8/20 | 0.70 |
| ▸ | HTR2A | P28223 | 1/20 | 0.70 |
| ▸ | HTR7 | P34969 | 1/20 | 0.70 |
| ▸ | HTR2B | P41595 | 1/20 | 0.70 |
| ▸ | CLK2 | P49760 | 2/20 | 0.42 |
| ▸ | CLK3 | P49761 | 2/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Adoprazine SCHEMBL678503 | 0.82 | DRD2 (1.00) | DRD2HTR1ADRD4DRD3HTR2A | |
| Adoprazine SCHEMBL29522743 | 0.82 | DRD2 (1.00) | DRD2HTR1ADRD4DRD3HTR2A | |
| Adoprazine SCHEMBL4179481 | 0.82 | DRD2 (1.00) | DRD2HTR1ADRD4DRD3HTR2A | |
| SCHEMBL7507917 | 0.79 | DRD2 (0.79) | DRD2HTR1ADRD4DRD3HTR2A | |
| SCHEMBL6863375 | 0.79 | DRD2 (0.80) | DRD2HTR1ADRD4DRD3HTR7 | |
| SCHEMBL7505601 | 0.79 | DRD2 (1.00) | DRD2HTR1ADRD4DRD3HTR2A | |
| Hydrochloric Acid SCHEMBL7977424 | 0.79 | DRD2 (0.78) | DRD2HTR1ADRD4DRD3HTR2A | |
| Hydrochloric Acid SCHEMBL7991689 | 0.78 | DRD2 (0.98) | DRD2HTR1ADRD4DRD3HTR2A | |
| Hydrochloric Acid SCHEMBL27480305 | 0.78 | DRD2 (0.98) | DRD2HTR1ADRD4DRD3HTR2A | |
| SCHEMBL7510183 | 0.77 | DRD2 (0.79) | DRD2HTR1ADRD4DRD3HTR2A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011088838-A1 | NOVEL 6,6A,7,8,9,10-HEXAHYDRO-4H-4,8,10A-TRIAZA-ACEPHENANTHRYLENE DERIVATIVES AS DOPAMINE D2 LIGANDS | H. LUNDBECK A/S (DK) | 2011-07-28 | — | — | WO | disclosed |