Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | NPY1R | P25929 | 4/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.33 |
| ▸ | CXCR4 | P61073 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.32 |
| ▸ | AVPR1B | P47901 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | UGCG | Q16739 | 1/20 | 0.32 |
| ▸ | PDE2A | O00408 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4170089 | 1.00 | KDM1A (0.36) | KDM1ANPY1RSLC6A4KCNH2ADRA1D | |
| SCHEMBL4181353 | 1.00 | KDM1A (0.36) | KDM1ANPY1RSLC6A4KCNH2ADRA1D | |
| SCHEMBL4175835 | 0.95 | KDM1A (0.35) | KDM1ANPY1RSLC6A4KCNH2CXCR4 | |
| SCHEMBL4178166 | 0.84 | MAPT (0.38) | NPY1RSLC6A4KCNH2GAAPDE2A | |
| SCHEMBL4173715 | 0.84 | MAPT (0.38) | NPY1RSLC6A4KCNH2GAAPDE2A | |
| SCHEMBL5547304 | 0.84 | MAPT (0.38) | NPY1RSLC6A4KCNH2GAAPDE2A | |
| SCHEMBL13875174 | 0.78 | HDAC1 (0.35) | KCNH2CXCR4 | |
| SCHEMBL4887081 | 0.76 | KDM1A (0.42) | KDM1ANPY1RSLC6A4KCNH2CXCR4 | |
| SCHEMBL3083828 | 0.76 | KDM1A (0.42) | KDM1ANPY1RSLC6A4KCNH2CXCR4 | |
| SCHEMBL14566706 | 0.76 | KDM1A (0.42) | KDM1ANPY1RSLC6A4KCNH2CXCR4 |
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-1853604-A2 | CHEMICAL COMPOUNDS | SmithKline Beecham Corporation (US) | 2007-11-14 | — | — | EP | disclosed |
| WO-2006096444-A2 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2006-09-14 | — | — | WO | disclosed |