Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 5/20 | 0.45 |
| ▸ | ITGA2B | P08514 | 5/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.43 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | ITGAV | P06756 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 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 | |
|---|---|---|---|---|
| SCHEMBL10715821 | 0.99 | LMNA (0.45) | ITGB3ITGA2BLMNAL3MBTL1MEN1 | |
| SCHEMBL10717125 | 0.99 | LMNA (0.45) | ITGB3ITGA2BLMNAL3MBTL1MEN1 | |
| SCHEMBL10715610 | 0.97 | ITGB3 (0.47) | ITGB3ITGA2BLMNAMEN1ALDH1A1 | |
| SCHEMBL10715672 | 0.96 | ITGB3 (0.49) | ITGB3ITGA2BLMNAMEN1ALDH1A1 | |
| SCHEMBL10715749 | 0.96 | LMNA (0.44) | ITGB3ITGA2BLMNAL3MBTL1MEN1 | |
| SCHEMBL10717202 | 0.96 | MEN1 (0.47) | ITGB3ITGA2BLMNAMEN1ALDH1A1 | |
| SCHEMBL10715662 | 0.96 | MEN1 (0.47) | ITGB3ITGA2BLMNAMEN1ALDH1A1 | |
| SCHEMBL8453774 | 0.96 | ITGB3 (0.48) | ITGB3ITGA2BLMNAL3MBTL1MEN1 | |
| SCHEMBL8040191 | 0.96 | ITGB3 (0.48) | ITGB3ITGA2BLMNAL3MBTL1MEN1 | |
| SCHEMBL10715700 | 0.95 | ITGB3 (0.48) | ITGB3ITGA2BLMNAMEN1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0125563-B1 | BICYCLOHEXYL ETHANES | MERCK PATENT GmbH (DE) | 1987-05-27 | — | — | EP | disclosed |
| EP-0125563-A2 | Bicyclohexyl ethanes | MERCK PATENT GmbH (DE) | 1984-11-21 | — | — | EP | disclosed |