Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | SLC6A1 | P30531 | 2/20 | 0.37 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.37 |
| ▸ | SLC6A12 | P48065 | 2/20 | 0.37 |
| ▸ | SLC6A11 | P48066 | 2/20 | 0.37 |
| ▸ | SLC6A13 | Q9NSD5 | 2/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.37 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.37 |
| ▸ | ANPEP | P15144 | 1/20 | 0.36 |
| ▸ | ENPEP | Q07075 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30659860 | 0.92 | ALDH1A1 (0.50) | ALDH1A1POLBMAPTTDP1SLC6A1 | |
| SCHEMBL15723398 | 0.80 | ALDH1A1 (0.56) | ALDH1A1POLBMAPTTDP1SLC6A1 | |
| SCHEMBL177588 | 0.76 | — | — | |
| SCHEMBL221946 | 0.76 | — | — | |
| Ethylene SCHEMBL28073446 | 0.74 | EPHX1 (0.48) | ALDH1A1POLBMAPTTDP1SLC6A1 | |
| SCHEMBL177931 | 0.74 | EPHX1 (0.52) | ALDH1A1POLBMAPTTDP1SLC6A1 | |
| SCHEMBL14456385 | 0.74 | EPHX1 (0.52) | ALDH1A1POLBMAPTTDP1SLC6A1 | |
| SCHEMBL11098596 | 0.74 | EPHX1 (0.52) | ALDH1A1POLBMAPTTDP1SLC6A1 | |
| Water SCHEMBL15822606 | 0.74 | SLC6A12 (0.48) | ALDH1A1POLBMAPTTDP1SLC6A1 | |
| SCHEMBL5711897 | 0.74 | EPHX1 (0.52) | ALDH1A1POLBMAPTTDP1SLC6A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1097928-B1 | 5-(2,3-Dialkoxyphenyl)-4,1-benzoxazepin-2-ones as anti-hyperlipidemics | TAKEDA PHARMACEUTICAL (JP) | 2008-07-16 | — | — | EP | disclosed |