Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NAAA | Q02083 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | THRA | P10827 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | MLYCD | O95822 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL8090137 | 0.89 | NPC1 (0.45) | NPC1RAB9AALDH1A1L3MBTL1HPGD | |
| SCHEMBL8091494 | 0.88 | SPHK1 (0.34) | NPC1RAB9AALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL8091585 | 0.84 | SPHK1 (0.31) | NPC1RAB9ASPHK1 | |
| SCHEMBL8090163 | 0.83 | MAPK1 (0.41) | NPC1RAB9AALDH1A1L3MBTL1POLB | |
| SCHEMBL8091591 | 0.83 | SPHK1 (0.31) | NPC1RAB9ASPHK1 | |
| SCHEMBL8083451 | 0.82 | MAPK1 (0.40) | NPC1RAB9AALDH1A1L3MBTL1POLB | |
| SCHEMBL8098088 | 0.82 | ITGB3 (0.41) | NPC1RAB9AALDH1A1L3MBTL1HPGD | |
| SCHEMBL8095245 | 0.81 | MAPK1 (0.43) | NPC1RAB9AALDH1A1L3MBTL1CA2 | |
| SCHEMBL8098001 | 0.81 | CXCR4 (0.43) | NPC1RAB9AALDH1A1L3MBTL1POLB | |
| SCHEMBL8091666 | 0.77 | NPC1 (0.47) | NPC1RAB9AALDH1A1L3MBTL1HPGD |
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-0792883-B1 | Novel derivates of boronic acid, process for their preparation and pharmaceutical compositions containing them | ADIR (FR) | 2000-12-20 | — | — | EP | disclosed |
| EP-0792883-A1 | Novel derivates of boronic acid, process for their preparation and pharmaceutical compositions containing them | ADIR ET COMPAGNIE (FR) | 1997-09-03 | — | — | EP | disclosed |