Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | GNAO1 | P09471 | 7/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.39 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.39 |
| ▸ | GNAI3 | P08754 | 6/20 | 0.39 |
| ▸ | GNAI1 | P63096 | 6/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | SOD3 | P08294 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GBA1 | P04062 | 3/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6284637 | 0.98 | TAAR1 (0.43) | TAAR1GNAO1S1PR1S1PR3S1PR5 | |
| SCHEMBL881080 | 0.85 | SLC6A2 (0.40) | TAAR1GNAO1CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL8560784 | 0.84 | RAD52 (0.35) | TAAR1 | |
| SCHEMBL8555780 | 0.84 | RAD52 (0.35) | TAAR1 | |
| Hydrazine SCHEMBL8557324 | 0.83 | RAD52 (0.34) | TAAR1 | |
| SCHEMBL6439309 | 0.83 | TAAR1 (0.52) | TAAR1GNAO1S1PR1S1PR3S1PR5 | |
| SCHEMBL6566400 | 0.83 | TAAR1 (0.52) | TAAR1GNAO1S1PR1S1PR3S1PR5 | |
| Hydrazine SCHEMBL8561436 | 0.83 | RAD52 (0.34) | TAAR1 | |
| SCHEMBL28011845 | 0.83 | TAAR1 (0.52) | TAAR1GNAO1S1PR1S1PR3S1PR5 | |
| SCHEMBL27832364 | 0.83 | TAAR1 (0.52) | TAAR1GNAO1S1PR1S1PR3S1PR5 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1673089-A2 | PHENYL-PIPERAZINE DERIVATIVES AS MODULATORS OF MUSCARINIC RECEPTORS | Vertex Pharmaceuticals Incorporated (US) | 2006-06-28 | — | — | EP | claimed |
| WO-2005030188-A2 | PHENYL-PIPERAZINE DERIVATIVES AS MODULATORS OF MUSCARINIC RECEPTORS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2005-04-07 | — | — | WO | claimed |
| EP-1673089-A2 | PHENYL-PIPERAZINE DERIVATIVES AS MODULATORS OF MUSCARINIC RECEPTORS | Vertex Pharmaceuticals Incorporated (US) | 2006-06-28 | — | — | EP | disclosed |
| WO-2005030188-A2 | PHENYL-PIPERAZINE DERIVATIVES AS MODULATORS OF MUSCARINIC RECEPTORS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2005-04-07 | — | — | WO | disclosed |