Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 18/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 17/20 | 0.42 |
| ▸ | DRD2 | P14416 | 15/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CTSS | P25774 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3571332 | 1.00 | DRD3 (0.42) | DRD3KCNH2DRD2CYP1A2CYP2C19 | |
| Hydrochloric Acid SCHEMBL3560443 | 0.99 | DRD3 (0.41) | DRD3KCNH2DRD2CYP1A2CYP2C19 | |
| SCHEMBL13314359 | 0.89 | DRD3 (0.44) | DRD3KCNH2DRD2CYP1A2CYP2C19 | |
| SCHEMBL3568297 | 0.89 | DRD3 (0.44) | DRD3KCNH2DRD2CYP1A2CYP2C19 | |
| SCHEMBL3563073 | 0.89 | KCNH2 (0.49) | DRD3KCNH2DRD2CYP1A2 | |
| Hydrochloric Acid SCHEMBL3557029 | 0.89 | DRD3 (0.44) | DRD3KCNH2DRD2CYP1A2CYP2C19 | |
| Hydrochloric Acid SCHEMBL3553818 | 0.88 | KCNH2 (0.49) | DRD3KCNH2DRD2CYP1A2 | |
| SCHEMBL3562589 | 0.87 | KCNH2 (0.49) | DRD3KCNH2DRD2CYP1A2 | |
| Hydrochloric Acid SCHEMBL3560961 | 0.86 | KCNH2 (0.49) | DRD3KCNH2DRD2CYP1A2 | |
| SCHEMBL3563081 | 0.85 | DRD3 (0.48) | DRD3KCNH2DRD2CYP1A2CYP2C19 |
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-2007750-A1 | AZABICYCLO [3. 1. 0] HEXYL DERIVATIVES AS MODULATORS OF DOPAMINE D3 RECEPTORS | GLAXO GROUP LIMITED (GB) | 2008-12-31 | — | — | EP | disclosed |
| WO-2007113232-A1 | AZABICYCLO [3. 1. 0] HEXYL DERIVATIVES AS MODULATORS OF DOPAMINE D3 RECEPTORS | GLAXO GROUP LIMITED (GB) | 2007-10-11 | — | — | WO | disclosed |