Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.57 |
| ▸ | PPARG | P37231 | 1/20 | 0.55 |
| ▸ | PPARA | Q07869 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.52 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.52 |
| ▸ | TAS1R2 | Q8TE23 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | PYGL | P06737 | 3/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | GFER | P55789 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.49 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.49 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.49 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL17498480 | 0.88 | RAB9A (0.56) | RAB9APPARGPPARANPC1ALDH1A1 | |
| SCHEMBL7340569 | 0.87 | PYGL (0.61) | RAB9ANPC1KDM4EALDH1A1PYGL | |
| SCHEMBL7332090 | 0.85 | PYGL (0.62) | RAB9APPARGNPC1KDM4EALDH1A1 | |
| SCHEMBL16160866 | 0.84 | RAB9A (0.51) | RAB9APPARGPPARANPC1ALDH1A1 | |
| SCHEMBL8812458 | 0.84 | RAB9A (0.57) | RAB9APPARGPPARANPC1KDM4E | |
| SCHEMBL27561744 | 0.83 | NR1H4 (0.57) | PPARGPPARANPC1KDM4EALDH1A1 | |
| SCHEMBL6972628 | 0.82 | RAB9A (0.58) | RAB9APPARGPPARANPC1TAS1R3 | |
| SCHEMBL8313578 | 0.80 | PYGL (0.56) | RAB9APPARGNPC1KDM4EALDH1A1 | |
| SCHEMBL7372458 | 0.79 | RAB9A (0.57) | RAB9APPARGNPC1KDM4EALDH1A1 | |
| SCHEMBL6968515 | 0.78 | PYGL (0.57) | RAB9APPARGNPC1KDM4EALDH1A1 |
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-0636625-B1 | Tricyclic diazepines vasopressin and oxytocin antagonists | AMERICAN CYANAMID CO (US) | 1999-01-27 | — | — | EP | disclosed |