Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | MMP8 | P22894 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | PLAAT3 | P53816 | 1/20 | 0.34 |
| ▸ | PLAAT5 | Q96KN8 | 1/20 | 0.34 |
| ▸ | PLAAT2 | Q9NWW9 | 1/20 | 0.34 |
| ▸ | PLAAT4 | Q9UL19 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | TACR1 | P25103 | 1/20 | 0.34 |
| ▸ | TACR3 | P29371 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8090112 | 0.93 | CYP2C19 (0.39) | CYP2C19CYP3A4MMP8NPC1ALDH1A1 | |
| SCHEMBL8095467 | 0.90 | CYP3A4 (0.38) | CYP2C19CYP3A4MMP8NPC1ALDH1A1 | |
| SCHEMBL8095269 | 0.89 | MMP1 (0.38) | CYP2C19CYP3A4MMP8EPHX1 | |
| SCHEMBL8090189 | 0.87 | MMP8 (0.37) | CYP2C19CYP3A4MMP8EPHX1MEN1 | |
| SCHEMBL8098091 | 0.85 | MMP8 (0.43) | CYP2C19MMP8NPC1ALDH1A1HPGD | |
| SCHEMBL8090145 | 0.84 | CHRM5 (0.35) | CYP2C19CYP3A4MMP8NPC1ALDH1A1 | |
| SCHEMBL8095466 | 0.83 | CYP2C19 (0.39) | CYP2C19CYP3A4MMP8NPC1ALDH1A1 | |
| SCHEMBL8095221 | 0.83 | MMP8 (0.41) | CYP2C19MMP8KMT2A | |
| SCHEMBL8095266 | 0.82 | MMP1 (0.39) | CYP2C19CYP3A4MMP8MEN1KMT2A | |
| SCHEMBL8090134 | 0.82 | KDM4E (0.36) | CYP2C19NPC1RAB9AKDM4ECYP1A2 |
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 |