Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | RRM1 | P23921 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | XBP1 | P17861 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | FYN | P06241 | 1/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
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 | 1.00 | AOC3 (0.41) | AOC3NPC1RAB9ARRM1CHRM2 | |
| SCHEMBL9729035 | 0.99 | AOC3 (0.42) | AOC3NPC1RAB9ARRM1CHRM2 | |
| SCHEMBL9729725 | 0.94 | AOC3 (0.43) | AOC3NPC1RAB9AGAAALDH1A1 | |
| Fumaric Acid SCHEMBL10525061 | 0.89 | ALDH1A1 (0.42) | NPC1RAB9ARRM1GAAALDH1A1 | |
| Fumaric Acid SCHEMBL10525066 | 0.89 | ALDH1A1 (0.42) | NPC1RAB9ARRM1GAAALDH1A1 | |
| SCHEMBL9729325 | 0.88 | AOC3 (0.45) | AOC3GAAALDH1A1MAPTLMNA | |
| SCHEMBL9729174 | 0.80 | AOC3 (0.49) | AOC3RAB9ARRM1CHRM2ALDH1A1 | |
| SCHEMBL10523671 | 0.80 | AOC3 (0.49) | AOC3RAB9ARRM1CHRM2ALDH1A1 | |
| SCHEMBL9729228 | 0.79 | AOC3 (0.50) | AOC3RAB9ARRM1CHRM2ALDH1A1 | |
| SCHEMBL9729333 | 0.77 | LMNA (0.41) | AOC3CHRM2GAAALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| 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 |