Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 2/20 | 0.46 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8091503 | 0.99 | SMYD3 (0.47) | NAMPTSMYD3MAPK1CYP1A2TSHR | |
| SCHEMBL8095245 | 0.88 | MAPK1 (0.43) | NAMPTMAPK1MAOBNPC1RAB9A | |
| SCHEMBL8095265 | 0.87 | SMYD3 (0.48) | NAMPTSMYD3MAPK1CYP1A2TSHR | |
| SCHEMBL8083451 | 0.86 | MAPK1 (0.40) | NAMPTMAPK1CYP1A2TSHRNFKB1 | |
| SCHEMBL8095330 | 0.84 | NPC1 (0.49) | NAMPTSMYD3MAPK1NPC1RAB9A | |
| SCHEMBL8091666 | 0.82 | NPC1 (0.47) | NAMPTSMYD3MAPK1CYP1A2TSHR | |
| SCHEMBL12960847 | 0.80 | MAPK1 (0.65) | NAMPTSMYD3MAPK1CYP1A2TSHR | |
| SCHEMBL26709560 | 0.80 | MAPK1 (0.65) | NAMPTSMYD3MAPK1CYP1A2TSHR | |
| SCHEMBL8083552 | 0.80 | CTSB (0.33) | SMYD3CYP1A2TSHRNFKB1MAOB | |
| SCHEMBL8091498 | 0.79 | CYP1A2 (0.32) | CYP1A2TSHRNFKB1MAOBMEN1 |
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 |