Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.76 |
| ▸ | MLLT1 | Q03111 | 1/20 | 0.56 |
| ▸ | F7 | P08709 | 1/20 | 0.55 |
| ▸ | F3 | P13726 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | PYGL | P06737 | 11/20 | 0.52 |
| ▸ | NHERF1 | O14745 | 1/20 | 0.52 |
| ▸ | PYGM | P11217 | 6/20 | 0.52 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.51 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL11888212 | 0.87 | SMYD3 (0.79) | SMYD3MLLT1F7F3PYGL | |
| SCHEMBL12507532 | 0.87 | SMYD3 (0.71) | SMYD3MLLT1MEN1RAB9AKMT2A | |
| SCHEMBL21489923 | 0.86 | SMYD3 (1.00) | SMYD3MLLT1F7F3MEN1 | |
| SCHEMBL19710296 | 0.86 | SMYD3 (1.00) | SMYD3MLLT1F7F3MEN1 | |
| SCHEMBL10279509 | 0.86 | SMYD3 (0.70) | SMYD3MLLT1PYGLHRH4HRH3 | |
| SCHEMBL763943 | 0.86 | SMYD3 (0.77) | SMYD3MLLT1F7F3PYGL | |
| SCHEMBL12101152 | 0.85 | MLLT1 (0.56) | SMYD3MLLT1NPC1RAB9APYGL | |
| SCHEMBL30578672 | 0.85 | SMYD3 (0.76) | SMYD3MLLT1F7F3MEN1 | |
| SCHEMBL11960283 | 0.84 | SMYD3 (0.74) | SMYD3MLLT1PYGLNHERF1PYGM | |
| SCHEMBL12670484 | 0.84 | SMYD3 (0.74) | SMYD3MLLT1PYGLNHERF1PYGM |
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-1577301-B1 | Antithrombotic diaminocyclohexane derivatives | DAIICHI SANKYO CO LTD (JP) | 2012-09-12 | — | — | EP | disclosed |