Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | FDPS | P14324 | 1/20 | 0.41 |
| ▸ | ESRRG | P62508 | 5/20 | 0.40 |
| ▸ | ESRRB | O95718 | 1/20 | 0.39 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 2/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8766151 | 0.82 | ESRRG (0.41) | NPC1RAB9AGAACYP2D6MAPT | |
| SCHEMBL8766645 | 0.78 | FDPS (0.41) | NPC1RAB9AGAACYP2D6MAPT | |
| SCHEMBL8766734 | 0.75 | ESRRG (0.41) | GAACYP2D6MAPTSMN1; SMN2CYP1A2 | |
| SCHEMBL2988813 | 0.75 | ESR1 (0.46) | CYP2C19ESRRGALDH1A1KDM4EESR1 | |
| SCHEMBL16301895 | 0.72 | ESR1 (0.43) | CYP2C19ESRRGALDH1A1KDM4EESR1 | |
| SCHEMBL5647781 | 0.70 | ESR1 (0.74) | NPC1RAB9AGAACYP2D6MAPT | |
| SCHEMBL2985103 | 0.69 | CA2 (0.37) | GAAMAPTGFERESRRGESRRB | |
| SCHEMBL3098921 | 0.68 | CA2 (0.39) | GAAMAPTGFERESRRGESRRB | |
| SCHEMBL16301936 | 0.68 | OPRK1 (0.39) | CYP2C19ALDH1A1KDM4EESR1ESR2 | |
| SCHEMBL4961889 | 0.68 | HTT (0.51) | NPC1RAB9AGAACYP2D6MAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0559079-B1 | Substituted aminophosphonate derivatives, process for their preparation and pharmaceutical compositions containing them | SYMPHAR SA (CH) | 1997-08-13 | — | — | EP | claimed |