Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 20/20 | 0.51 |
| ▸ | DRD3 | P35462 | 19/20 | 0.51 |
| ▸ | DRD2 | P14416 | 15/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3571063 | 1.00 | KCNH2 (0.51) | KCNH2DRD3DRD2CYP1A2CYP2C19 | |
| Hydrochloric Acid SCHEMBL3572641 | 0.99 | KCNH2 (0.50) | KCNH2DRD3DRD2CYP1A2CYP2C19 | |
| SCHEMBL10819295 | 0.87 | DRD3 (0.55) | KCNH2DRD3DRD2CYP1A2CYP2C19 | |
| SCHEMBL3570668 | 0.87 | DRD3 (0.55) | KCNH2DRD3DRD2CYP1A2CYP2C19 | |
| Hydrochloric Acid SCHEMBL3575163 | 0.86 | DRD3 (0.54) | KCNH2DRD3DRD2CYP1A2CYP2C19 | |
| SCHEMBL13463861 | 0.85 | DRD3 (0.61) | KCNH2DRD3DRD2CYP1A2CYP2C19 | |
| SCHEMBL3567759 | 0.85 | DRD3 (0.61) | KCNH2DRD3DRD2CYP1A2CYP2C19 | |
| SCHEMBL3571070 | 0.85 | DRD3 (0.48) | KCNH2DRD3DRD2CYP1A2CYP2C19 | |
| SCHEMBL3571649 | 0.85 | DRD3 (0.48) | KCNH2DRD3DRD2CYP1A2 | |
| Hydrochloric Acid SCHEMBL3581706 | 0.85 | DRD3 (0.48) | KCNH2DRD3DRD2CYP1A2CYP2C19 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2007751-A1 | AZABICYCLO [3. 1. O] HEXYL DERIVATIVES AS MODULATORS OF DOPAMINE D3 RECEPTORS | GLAXO GROUP LIMITED (GB) | 2008-12-31 | — | — | EP | disclosed |
| WO-2007113260-A1 | AZABICYCLO [3. 1. O] HEXYL DERIVATIVES AS MODULATORS OF DOPAMINE D3 RECEPTORS | GLAXO GROUP LIMITED (GB) | 2007-10-11 | — | — | WO | disclosed |