Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | ASAH1 | Q13510 | 2/20 | 0.44 |
| ▸ | ACER2 | Q5QJU3 | 1/20 | 0.44 |
| ▸ | NAAA | Q02083 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | TLR2 | O60603 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | XBP1 | P17861 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9729205 | 0.94 | ALDH1A1 (0.46) | SMN1; SMN2NPC1RAB9AALDH1A1ASAH1 | |
| SCHEMBL9729471 | 0.88 | ALDH1A1 (0.52) | SMN1; SMN2NPC1RAB9AALDH1A1TSHR | |
| SCHEMBL9729300 | 0.82 | AOC3 (0.41) | SMN1; SMN2ALDH1A1LMNATSHRAOC3 | |
| SCHEMBL4083083 | 0.79 | AOC3 (0.53) | RAB9AALDH1A1ASAH1ACER2LMNA | |
| SCHEMBL9729958 | 0.79 | ALDH1A1 (0.59) | SMN1; SMN2ALDH1A1LMNATSHRAOC3 | |
| SCHEMBL9729078 | 0.79 | ALDH1A1 (0.47) | SMN1; SMN2RAB9AALDH1A1LMNATSHR | |
| SCHEMBL18770913 | 0.77 | SMN1; SMN2 (0.46) | SMN1; SMN2NPC1RAB9AALDH1A1ASAH1 | |
| SCHEMBL10523671 | 0.75 | AOC3 (0.49) | RAB9AALDH1A1NAAALMNATSHR | |
| SCHEMBL9729174 | 0.75 | AOC3 (0.49) | RAB9AALDH1A1NAAALMNATSHR | |
| SCHEMBL9728882 | 0.75 | HPGD (0.49) | ALDH1A1LMNATSHRAOC3MEN1 |
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 |