Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A12 | P48065 | 6/20 | 0.42 |
| ▸ | SLC6A11 | P48066 | 6/20 | 0.42 |
| ▸ | SLC6A13 | Q9NSD5 | 6/20 | 0.42 |
| ▸ | SLC6A1 | P30531 | 3/20 | 0.41 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.41 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.41 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | ANPEP | P15144 | 1/20 | 0.35 |
| ▸ | ENPEP | Q07075 | 1/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.33 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.33 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28513346 | 0.89 | SLC6A12 (0.50) | SLC6A12SLC6A11SLC6A13SLC6A1GABRA5 | |
| SCHEMBL28103618 | 0.81 | SLC6A12 (0.41) | SLC6A12SLC6A11SLC6A13SLC6A1GABRA5 | |
| SCHEMBL3569625 | 0.79 | ANPEP (0.48) | SLC6A12SLC6A11SLC6A13SLC6A1GABRA5 | |
| SCHEMBL2708681 | 0.79 | ANPEP (0.48) | SLC6A12SLC6A11SLC6A13SLC6A1GABRA5 | |
| SCHEMBL11693682 | 0.78 | SLC6A12 (0.50) | SLC6A12SLC6A11SLC6A13SLC6A1GABRA5 | |
| SCHEMBL337975 | 0.77 | EPHX2 (0.41) | SLC6A12SLC6A11SLC6A13TDP1EPHX2 | |
| SCHEMBL19650816 | 0.77 | SLC6A12 (0.46) | SLC6A12SLC6A11SLC6A13SLC6A1GABRA5 | |
| SCHEMBL1924098 | 0.77 | EPHX2 (0.41) | SLC6A12SLC6A11SLC6A13TDP1EPHX2 | |
| SCHEMBL13940976 | 0.77 | EPHX2 (0.41) | ALDH1A1TDP1EPHX2NR1H2 | |
| SCHEMBL10248709 | 0.77 | ALDH1A1 (0.44) | SLC6A12SLC6A11SLC6A13SLC6A1GABRA5 |
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-2016093342-A1 | DIHYDROPYRIMIDINE-2-ONE COMPOUNDS AND MEDICINAL USES THEREOF | 日本たばこ産業株式会社 | 2016-06-16 | — | — | WO | disclosed |