Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | GRIA4 | P48058 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 4/20 | 0.37 |
| ▸ | CA1 | P00915 | 3/20 | 0.37 |
| ▸ | CA2 | P00918 | 3/20 | 0.37 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | APP | P05067 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL17090382 | 0.92 | ALDH1A1 (0.35) | ALDH1A1POLBHPGDGRIA4CA9 | |
| SCHEMBL13565926 | 0.86 | ALDH1A1 (0.44) | ALDH1A1POLBHPGDGRIA4CA9 | |
| SCHEMBL17089996 | 0.79 | ALDH1A1 (0.41) | ALDH1A1POLBHPGDGRIA4CNR2 | |
| SCHEMBL13565911 | 0.78 | ALDH1A1 (0.38) | ALDH1A1POLBHPGDCNR2HTT | |
| SCHEMBL13565859 | 0.77 | CNR2 (0.41) | ALDH1A1POLBHPGDCA9CA1 | |
| SCHEMBL17090431 | 0.77 | CNR2 (0.41) | ALDH1A1POLBHPGDCA9CA1 | |
| SCHEMBL11935406 | 0.75 | ALDH1A1 (0.51) | ALDH1A1POLBHPGDCA9CA1 | |
| SCHEMBL13439153 | 0.75 | ALDH1A1 (0.51) | ALDH1A1POLBHPGDCA9CA1 | |
| SCHEMBL17090534 | 0.74 | ALDH1A1 (0.41) | ALDH1A1HPGDCA9CA12NPC1 | |
| SCHEMBL13566017 | 0.74 | ALDH1A1 (0.41) | ALDH1A1HPGDCA9CA12NPC1 |
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 |