Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | RRM1 | P23921 | 1/20 | 0.37 |
| ▸ | SLC10A1 | Q14973 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 2/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9729159 | 0.99 | AOC3 (0.41) | AOC3GAANPC1RAB9AALDH1A1 | |
| SCHEMBL9729075 | 0.99 | AOC3 (0.41) | AOC3GAANPC1RAB9AALDH1A1 | |
| SCHEMBL9729725 | 0.95 | AOC3 (0.43) | AOC3GAANPC1RAB9AALDH1A1 | |
| SCHEMBL9729325 | 0.89 | AOC3 (0.45) | AOC3GAAALDH1A1MAPTSLC10A1 | |
| Fumaric Acid SCHEMBL10525061 | 0.88 | ALDH1A1 (0.42) | GAANPC1RAB9AALDH1A1RRM1 | |
| Fumaric Acid SCHEMBL10525066 | 0.88 | ALDH1A1 (0.42) | GAANPC1RAB9AALDH1A1RRM1 | |
| SCHEMBL9729228 | 0.80 | AOC3 (0.50) | AOC3RAB9AALDH1A1MAPTRRM1 | |
| SCHEMBL9729174 | 0.78 | AOC3 (0.49) | AOC3RAB9AALDH1A1RRM1CHRM2 | |
| SCHEMBL9729333 | 0.78 | LMNA (0.41) | AOC3GAAALDH1A1MAPTCNR2 | |
| SCHEMBL10523671 | 0.78 | AOC3 (0.49) | AOC3RAB9AALDH1A1RRM1CHRM2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4803200-A | SHIPPING FEVER SYNDROME | A. H. ROBINS COMPANY, INCORPORATED (US) | 1989-02-07 | — | — | US | claimed |
| US-5171753-A | Derivatives of 2-amino-1-phenylethanol having antiulcer activity | A. H. ROBINS COMPANY, INCORPORATED (US) | 1992-12-15 | — | — | US | disclosed |
| US-4803200-A | SHIPPING FEVER SYNDROME | A. H. ROBINS COMPANY, INCORPORATED (US) | 1989-02-07 | — | — | US | disclosed |