Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KRAS | P01116 | 1/20 | 0.37 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CASR | P41180 | 5/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | PRKCG | P05129 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7780432 | 0.87 | ALDH1A1 (0.41) | KRASSOS1ALDH1A1CYP3A4CASR | |
| SCHEMBL7780640 | 0.87 | ALDH1A1 (0.41) | KRASSOS1ALDH1A1CYP3A4CASR | |
| SCHEMBL7785127 | 0.87 | ALDH1A1 (0.41) | KRASSOS1ALDH1A1CYP3A4CASR | |
| SCHEMBL7787479 | 0.85 | MEN1 (0.39) | ALDH1A1CYP3A4CASRMEN1KMT2A | |
| SCHEMBL7780419 | 0.84 | KRAS (0.43) | KRASSOS1ALDH1A1CASRGAA | |
| SCHEMBL7785661 | 0.83 | MAPK1 (0.39) | ALDH1A1CYP3A4MEN1KMT2AMAPT | |
| SCHEMBL7787455 | 0.81 | CYP2D6 (0.39) | ALDH1A1CASRMEN1GAAKMT2A | |
| SCHEMBL7785017 | 0.79 | MEN1 (0.39) | ALDH1A1MEN1GAAKMT2AMAPT | |
| SCHEMBL7784903 | 0.79 | ALDH1A1 (0.37) | ALDH1A1CYP3A4CASRMEN1GAA | |
| SCHEMBL7784936 | 0.78 | PDPK1 (0.39) | KRASSOS1ALDH1A1CYP3A4CASR |
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-6329405-B1 | AS ILEAL BILE ACID TRANSPORTER INHIBITOR, FOR THERAPY OF HYPERLIPEMIA | SANKYO COMPANY, LIMITED (JP) | 2001-12-11 | — | — | US | disclosed |
| CN-1287117-A | Cyclobutene derivatives, preparation method and therapeutic use thereof | SANKYO CO (JP) | 2001-03-14 | — | — | CN | disclosed |
| EP-1070703-A1 | Cyclobutene derivatives | Sankyo Company Limited (JP) | 2001-01-24 | — | — | EP | disclosed |