Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 19/20 | 0.68 |
| ▸ | KCNH2 | Q12809 | 17/20 | 0.68 |
| ▸ | DRD2 | P14416 | 17/20 | 0.66 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL2822364 | 1.00 | DRD3 (0.68) | DRD3KCNH2DRD2CYP1A2CYP2C19 | |
| SCHEMBL2819231 | 1.00 | DRD3 (0.68) | DRD3KCNH2DRD2CYP1A2CYP2C19 | |
| Hydrochloric Acid SCHEMBL2822299 | 0.99 | DRD3 (0.67) | DRD3KCNH2DRD2CYP1A2CYP2C19 | |
| SCHEMBL2822551 | 0.92 | DRD3 (0.75) | DRD3KCNH2DRD2CYP1A2CYP2C19 | |
| Hydrochloric Acid SCHEMBL2819910 | 0.91 | DRD3 (0.74) | DRD3KCNH2DRD2CYP1A2CYP2C19 | |
| SCHEMBL12313279 | 0.89 | DRD3 (0.86) | DRD3KCNH2DRD2CYP1A2 | |
| SCHEMBL2819368 | 0.87 | DRD3 (0.68) | DRD3KCNH2DRD2CYP1A2 | |
| SCHEMBL2819404 | 0.84 | DRD3 (0.59) | DRD3KCNH2DRD2CYP1A2CYP2C19 | |
| SCHEMBL2821345 | 0.84 | DRD3 (0.59) | DRD3KCNH2DRD2CYP1A2CYP2C19 | |
| Hydrochloric Acid SCHEMBL2825929 | 0.83 | DRD3 (0.58) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1891057-B1 | AZABICYCLO[3.1.0]HEXANE DERIVAIVES AS DOPAMIN D3 RECEPTOR MODULATORS | GLAXO GROUP LTD (GB) | 2010-10-27 | — | — | EP | disclosed |