Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 5/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 5/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 3/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 3/20 | 0.38 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.38 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 7/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 7/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 7/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.35 |
| ▸ | HTR2A | P28223 | 2/20 | 0.35 |
| ▸ | HTR2C | P28335 | 2/20 | 0.35 |
| ▸ | HTR2B | P41595 | 2/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5037533 | 0.78 | SLC6A2 (0.50) | SLC6A2SLC6A4SLC6A3HTR2AHTR2C | |
| SCHEMBL18291389 | 0.75 | CHRNB2 (0.49) | CHRNB2CHRNA4CHRNB4CHRNA3CYP2D6 | |
| SCHEMBL20038550 | 0.75 | CHRNB2 (0.49) | CHRNB2CHRNA4CHRNB4CHRNA3CYP2D6 | |
| SCHEMBL25707165 | 0.75 | CHRNB2 (0.49) | CHRNB2CHRNA4CHRNB4CHRNA3CYP2D6 | |
| SCHEMBL18291200 | 0.71 | CHRNB2 (0.45) | CHRNB2CHRNA4CHRNB4CHRNA3CYP2D6 | |
| SCHEMBL18291205 | 0.71 | CHRNB2 (0.45) | CHRNB2CHRNA4CHRNB4CHRNA3CYP2D6 | |
| SCHEMBL18291197 | 0.71 | CHRNB2 (0.45) | CHRNB2CHRNA4CHRNB4CHRNA3CYP2D6 | |
| SCHEMBL652324 | 0.67 | CHRNB2 (0.71) | CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL651734 | 0.67 | CHRNB2 (0.56) | CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL652325 | 0.67 | CHRNB2 (0.71) | CHRNB2CHRNA4CHRNB4CHRNA3 |
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-1656361-A1 | PIPERAZINE WITH OR-SUBSTITUTED PHENYL GROUP AND THEIR USE AS GLYT1 INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2006-05-17 | — | — | EP | disclosed |
| WO-2005014563-A1 | PIPERAZINE WITH OR-SUBSTITUTED PHENYL GROUP AND THEIR USE AS GLYT1 INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2005-02-17 | — | — | WO | disclosed |