Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | HRH1 | P35367 | 2/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | FES | P07332 | 1/20 | 0.35 |
| ▸ | RET | P07949 | 1/20 | 0.35 |
| ▸ | MARK3 | P27448 | 1/20 | 0.35 |
| ▸ | TYK2 | P29597 | 1/20 | 0.35 |
| ▸ | FLT4 | P35916 | 1/20 | 0.35 |
| ▸ | SYK | P43405 | 1/20 | 0.35 |
| ▸ | CLK2 | P49760 | 1/20 | 0.35 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8091395 | 0.94 | CYP2A6 (0.37) | CYP2A6CYP3A4HRH1HDAC8HDAC2 | |
| SCHEMBL8098060 | 0.90 | EPHX1 (0.36) | HDAC8HDAC2HDAC6EPHX1EPHX2 | |
| SCHEMBL8095466 | 0.89 | CYP2C19 (0.39) | CYP3A4EPHX1MEN1NPC1RAB9A | |
| SCHEMBL8095266 | 0.86 | MMP1 (0.39) | CYP3A4MEN1KMT2A | |
| SCHEMBL8090127 | 0.85 | KDM4E (0.36) | NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL8098087 | 0.84 | MMP8 (0.44) | EPHX2NPC1KMT2A | |
| SCHEMBL8098074 | 0.84 | EPHX1 (0.35) | HDAC8HDAC2HDAC6EPHX1EPHX2 | |
| SCHEMBL8090157 | 0.82 | MTNR1A (0.41) | PARP1RAB9ALMNA | |
| SCHEMBL8095467 | 0.82 | CYP3A4 (0.38) | CYP3A4EPHX1MEN1NPC1RAB9A | |
| SCHEMBL8095182 | 0.81 | MMP8 (0.40) | EPHX1 |
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 |