Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.47 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.47 |
| ▸ | GALR2 | O43603 | 4/20 | 0.46 |
| ▸ | GALR1 | P47211 | 4/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | GRM5 | P41594 | 2/20 | 0.43 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3886740 | 0.86 | GALR2 (0.49) | TRPV1TRPA1GALR2GALR1GAA | |
| SCHEMBL3878072 | 0.86 | GALR2 (0.59) | TRPV1GALR2GALR1 | |
| SCHEMBL3888381 | 0.85 | GALR2 (0.61) | TRPV1GALR2GALR1 | |
| SCHEMBL3877850 | 0.84 | EPHX2 (0.54) | TRPV1GALR2GALR1 | |
| SCHEMBL13761377 | 0.84 | GALR2 (0.51) | TRPV1GALR2GALR1 | |
| SCHEMBL3888266 | 0.83 | GALR2 (0.49) | GALR2GALR1HSD11B1 | |
| SCHEMBL3877704 | 0.83 | GALR2 (0.50) | TRPV1GALR2GALR1HSD11B1HRH3 | |
| SCHEMBL3877697 | 0.83 | GALR2 (0.50) | TRPV1GALR2GALR1GAAGRM5 | |
| SCHEMBL3878913 | 0.83 | TRPA1 (0.44) | TRPV1TRPA1GALR2GALR1GAA | |
| SCHEMBL3877905 | 0.82 | GALR2 (0.48) | GALR2GALR1HSD11B1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7566712-B2 | Biaryl piperazinyl-pyridine analogues | NEUROGEN CORPORATION (US) | 2009-07-28 | — | — | US | disclosed |
| US-7566712-B2 | Biaryl piperazinyl-pyridine analogues | NEUROGEN CORPORATION (US) | 2009-07-28 | — | — | US | disclosed |
| US-7566712-B2 | Biaryl piperazinyl-pyridine analogues | NEUROGEN CORPORATION (US) | 2009-07-28 | — | — | US | disclosed |