Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | NAMPT | P43490 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.41 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8091666 | 0.99 | NPC1 (0.47) | NPC1RAB9AALDH1A1NAMPTPOLB | |
| SCHEMBL8098115 | 0.88 | NPC1 (0.48) | NPC1RAB9AALDH1A1NAMPTPOLB | |
| SCHEMBL8090137 | 0.87 | NPC1 (0.45) | NPC1RAB9AALDH1A1NAMPTPOLB | |
| SCHEMBL8091625 | 0.85 | NPC1 (0.45) | NPC1RAB9AALDH1A1NAMPTPOLB | |
| SCHEMBL8083555 | 0.84 | NAMPT (0.46) | NPC1RAB9ANAMPTSMYD3L3MBTL1 | |
| SCHEMBL8095265 | 0.84 | SMYD3 (0.48) | NPC1RAB9AALDH1A1NAMPTPOLB | |
| SCHEMBL8091503 | 0.83 | SMYD3 (0.47) | NPC1RAB9AALDH1A1NAMPTPOLB | |
| SCHEMBL8095325 | 0.81 | POLB (0.33) | ALDH1A1POLBCA2 | |
| SCHEMBL8091664 | 0.80 | POLB (0.33) | ALDH1A1POLBCA2 | |
| SCHEMBL8748105 | 0.79 | KDM4E (0.48) | ALDH1A1POLBL3MBTL1MAPK1CA2 |
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 |