Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.39 |
| ▸ | CTSS | P25774 | 1/20 | 0.39 |
| ▸ | CTSK | P43235 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | KCNQ4 | P56696 | 1/20 | 0.36 |
| ▸ | KCNQ5 | Q9NR82 | 1/20 | 0.36 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.36 |
| ▸ | SYK | P43405 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL6905116 | 0.79 | SMN1; SMN2 (0.39) | SMN1; SMN2KMT2AMEN1L3MBTL1S1PR1 | |
| SCHEMBL6905120 | 0.78 | SMN1; SMN2 (0.38) | SMN1; SMN2KMT2AMEN1L3MBTL1S1PR1 | |
| SCHEMBL7062282 | 0.77 | SMN1; SMN2 (0.39) | SMN1; SMN2S1PR1NPC1RAB9AMAOB | |
| SCHEMBL7062273 | 0.77 | SMN1; SMN2 (0.39) | SMN1; SMN2S1PR1NPC1RAB9AMAOB | |
| SCHEMBL6684012 | 0.74 | NPC1 (0.37) | SMN1; SMN2KMT2AS1PR1CTSSCTSK | |
| Isobutane SCHEMBL7062276 | 0.72 | NPC1 (0.46) | SMN1; SMN2KMT2AMEN1L3MBTL1S1PR1 | |
| Hydrochloric Acid SCHEMBL6794609 | 0.72 | MAOB (0.51) | SMN1; SMN2S1PR1NPC1RAB9AMAOB | |
| Hydrochloric Acid SCHEMBL6672174 | 0.72 | MAOB (0.51) | SMN1; SMN2S1PR1NPC1RAB9AMAOB | |
| SCHEMBL7951856 | 0.71 | SYK (0.60) | SMN1; SMN2KMT2AMEN1NPC1RAB9A | |
| SCHEMBL23153559 | 0.71 | MAPT (0.45) | SMN1; SMN2KMT2AMEN1L3MBTL1NPC1 |
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-1482940-A2 | PRODRUGS OF SUBSTITUTED POLYCYCLIC COMPOUNDS USEFUL FOR SELECTIVE INHIBITION OF THE COAGULATION CASCADE | Pharmacia Corporation (US) | 2004-12-08 | — | — | EP | disclosed |
| WO-2003028729-A2 | PRODRUGS OF SUBSTITUTED POLYCYCLIC COMPOUNDS USEFUL FOR SELECTIVE INHIBITION OF THE COAGULATION CASCADE | PHARMACIA CORPORATION (US) | 2003-04-10 | — | — | WO | disclosed |