Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 4/20 | 0.52 |
| ▸ | ME2 | P23368 | 8/20 | 0.50 |
| ▸ | ME1 | P48163 | 8/20 | 0.50 |
| ▸ | ME3 | Q16798 | 8/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | RORC | P51449 | 1/20 | 0.42 |
| ▸ | SMO | Q99835 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | PANK3 | Q9H999 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16026531 | 0.88 | HRH3 (0.53) | AOC3ME2ME1ME3ALDH1A1 | |
| SCHEMBL29631001 | 0.87 | AOC3 (0.54) | AOC3ME2ME1ME3ALDH1A1 | |
| SCHEMBL27637330 | 0.84 | ME2 (0.53) | AOC3ME2ME1ME3AKR1C3 | |
| SCHEMBL3975617 | 0.81 | GPR119 (0.60) | AOC3HRH3HPGDSMN1; SMN2 | |
| SCHEMBL5234572 | 0.81 | PANK3 (0.55) | AOC3ME2ME1ME3HRH3 | |
| SCHEMBL29630970 | 0.80 | AOC3 (0.47) | AOC3ME2ME1ME3ALDH1A1 | |
| SCHEMBL29631039 | 0.79 | AOC3 (0.51) | AOC3ME2ME1ME3HPGD | |
| SCHEMBL29042361 | 0.79 | AOC3 (0.51) | AOC3ME2ME1ME3HPGD | |
| SCHEMBL21405134 | 0.78 | MAPT (0.57) | ALDH1A1SMO | |
| SCHEMBL29790369 | 0.78 | MAPT (0.57) | ALDH1A1SMO |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2074120-A1 | TROPANE COMPOUNDS | Exelixis, Inc. (US) | 2009-07-01 | — | — | EP | disclosed |
| WO-2009055077-A1 | TROPANE COMPOUNDS | EXELIXIS, INC. (US) | 2009-04-30 | — | — | WO | disclosed |