Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIA4 | P48058 | 2/20 | 0.45 |
| ▸ | GRIA2 | P42262 | 6/20 | 0.41 |
| ▸ | NPY5R | Q15761 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13565147 | 1.00 | GRIA4 (0.45) | GRIA4GRIA2NPY5RALDH1A1CYP3A4 | |
| SCHEMBL13565973 | 0.88 | GRIA4 (0.46) | GRIA4GRIA2NPY5RCYP3A4 | |
| SCHEMBL17090049 | 0.88 | GRIA2 (0.42) | GRIA4GRIA2NPY5R | |
| SCHEMBL11935089 | 0.88 | GRIA2 (0.42) | GRIA4GRIA2NPY5R | |
| SCHEMBL11935400 | 0.88 | GRIA4 (0.37) | GRIA4GRIA2NPY5RALDH1A1ALDH3A1 | |
| SCHEMBL13565851 | 0.88 | EPHX1 (0.42) | GRIA4GRIA2NPY5RALDH1A1KMT2A | |
| SCHEMBL17090525 | 0.88 | GRIA4 (0.46) | GRIA4GRIA2NPY5RCYP3A4 | |
| SCHEMBL17090527 | 0.88 | EPHX1 (0.42) | GRIA4GRIA2NPY5RALDH1A1KMT2A | |
| SCHEMBL13564970 | 0.88 | GRIA2 (0.46) | GRIA4GRIA2NPY5RALDH1A1KMT2A | |
| SCHEMBL13565560 | 0.88 | GRIA4 (0.46) | GRIA4GRIA2NPY5RALDH1A1ALDH3A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9139518-B2 | Amine derivative having NPY Y5 receptor antagonistic activity | SHIONOGI & CO., LTD. (JP) | 2015-09-22 | — | — | US | disclosed |