Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 20/20 | 0.80 |
| ▸ | KCNH2 | Q12809 | 19/20 | 0.80 |
| ▸ | DRD2 | P14416 | 16/20 | 0.80 |
| ▸ | DRD4 | P21917 | 1/20 | 0.77 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.60 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL378710 | 1.00 | DRD3 (0.80) | DRD3KCNH2DRD2DRD4CYP2C19 | |
| SCHEMBL378438 | 1.00 | DRD3 (0.80) | DRD3KCNH2DRD2DRD4CYP2C19 | |
| Hydrochloric Acid SCHEMBL4554725 | 0.99 | DRD3 (0.79) | DRD3KCNH2DRD2DRD4CYP2C19 | |
| Hydrochloric Acid SCHEMBL378272 | 0.99 | DRD3 (0.79) | DRD3KCNH2DRD2DRD4CYP2C19 | |
| SCHEMBL378509 | 0.89 | DRD3 (1.00) | DRD3KCNH2DRD2CYP2C19CHRM1 | |
| Hydrochloric Acid SCHEMBL393148 | 0.88 | DRD3 (0.98) | DRD3KCNH2DRD2CYP2C19CHRM1 | |
| Hydrochloric Acid SCHEMBL4411986 | 0.88 | DRD3 (0.98) | DRD3KCNH2DRD2CYP2C19CHRM1 | |
| Hydrochloric Acid SCHEMBL393147 | 0.88 | DRD3 (0.98) | DRD3KCNH2DRD2CYP2C19CHRM1 | |
| SCHEMBL378544 | 0.88 | DRD3 (0.78) | DRD3KCNH2DRD2DRD4CYP2C19 | |
| Hydrochloric Acid SCHEMBL378624 | 0.87 | DRD3 (0.76) | DRD3KCNH2DRD2DRD4CYP2C19 |
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-2060570-B1 | Azabicyclo[3.1.0] hexane derivatives useful as modulators of dopamine D3 receptors | GLAXO GROUP LTD (GB) | 2012-01-25 | — | — | EP | disclosed |