Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GHSR | Q92847 | 10/20 | 0.48 |
| ▸ | LTA4H | P09960 | 4/20 | 0.46 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3646815 | 1.00 | GHSR (0.48) | GHSRLTA4HCNR2CHRNB2CHRNA4 | |
| SCHEMBL3643849 | 1.00 | GHSR (0.48) | GHSRLTA4HCNR2CHRNB2CHRNA4 | |
| SCHEMBL13943896 | 0.89 | CNR2 (0.42) | GHSRCNR2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3648982 | 0.89 | CNR2 (0.42) | GHSRCNR2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3646957 | 0.85 | CHRNB2 (0.42) | GHSRCHRNB2CHRNA4SLC6A2SLC6A4 | |
| SCHEMBL3652735 | 0.82 | GHSR (0.50) | GHSRLTA4H | |
| SCHEMBL13943577 | 0.82 | GHSR (0.50) | GHSRLTA4H | |
| SCHEMBL13943090 | 0.79 | CHRNB4 (0.42) | GHSRCHRNB2CHRNA4 | |
| SCHEMBL3644382 | 0.79 | CHRNB4 (0.42) | GHSRCHRNB2CHRNA4 | |
| SCHEMBL3642601 | 0.75 | CHRNB2 (0.41) | GHSRCHRNB2CHRNA4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009016048-A1 | 2-AZETIDINEMETHANEAMINES AND 2-PYRROLIDINEMETHANEAMINES AS TAAR-LIGANDS | F. HOFFMANN-LA ROCHE AG (CH) | 2009-02-05 | — | — | WO | disclosed |