Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GBA1 | P04062 | 4/20 | 0.37 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.36 |
| ▸ | GUSB | P08236 | 1/20 | 0.36 |
| ▸ | PRCP | P42785 | 2/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | GLB1 | P16278 | 3/20 | 0.34 |
| ▸ | GBA2 | Q9HCG7 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL692526 | 0.90 | ALDH1A1 (0.41) | ALDH1A1GBA1SPHK1GUSBEPHX1 | |
| SCHEMBL5680185 | 0.88 | ALDH1A1 (0.44) | ALDH1A1GBA1SPHK1GUSBEPHX1 | |
| SCHEMBL28969103 | 0.88 | ALDH1A1 (0.44) | ALDH1A1GBA1SPHK1GUSBEPHX1 | |
| SCHEMBL27992831 | 0.88 | ALDH1A1 (0.44) | ALDH1A1GBA1SPHK1GUSBEPHX1 | |
| SCHEMBL5675531 | 0.88 | ALDH1A1 (0.44) | ALDH1A1GBA1SPHK1GUSBEPHX1 | |
| SCHEMBL21585703 | 0.88 | ALDH1A1 (0.44) | ALDH1A1GBA1SPHK1GUSBEPHX1 | |
| SCHEMBL5677084 | 0.88 | ALDH1A1 (0.44) | ALDH1A1GBA1SPHK1GUSBEPHX1 | |
| SCHEMBL4340747 | 0.88 | ALDH1A1 (0.44) | ALDH1A1GBA1SPHK1GUSBEPHX1 | |
| SCHEMBL5675532 | 0.88 | ALDH1A1 (0.44) | ALDH1A1GBA1SPHK1GUSBEPHX1 | |
| SCHEMBL28815780 | 0.88 | ALDH1A1 (0.44) | ALDH1A1GBA1SPHK1GUSBEPHX1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1995009832-A1 | NOVEL PROCESS FOR PREPARING POLYAMINE DERIVATIVES AND INTERMEDIATES THEREOF | MERRELL DOW PHARMACEUTICALS INC. (US) | 1995-04-13 | — | — | WO | claimed |
| WO-1995009832-A1 | NOVEL PROCESS FOR PREPARING POLYAMINE DERIVATIVES AND INTERMEDIATES THEREOF | MERRELL DOW PHARMACEUTICALS INC. (US) | 1995-04-13 | — | — | WO | disclosed |