Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | NSD2 | O96028 | 3/20 | 0.34 |
| ▸ | MMP2 | P08253 | 2/20 | 0.34 |
| ▸ | NSD3 | Q9BZ95 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.34 |
| ▸ | MMP3 | P08254 | 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 | |
|---|---|---|---|---|
| SCHEMBL8452968 | 1.00 | SIGMAR1 (0.42) | SIGMAR1NPC1RAB9AGSK3BMAOA | |
| SCHEMBL8458011 | 0.88 | SIGMAR1 (0.40) | SIGMAR1NPC1RAB9AGSK3BMAOA | |
| SCHEMBL8458005 | 0.88 | SIGMAR1 (0.40) | SIGMAR1NPC1RAB9AGSK3BMAOA | |
| SCHEMBL8450906 | 0.78 | SIGMAR1 (0.43) | SIGMAR1NPC1RAB9AGSK3BNSD2 | |
| SCHEMBL8450901 | 0.78 | SIGMAR1 (0.43) | SIGMAR1NPC1RAB9AGSK3BNSD2 | |
| SCHEMBL2277177 | 0.77 | GRIA1 (0.42) | SIGMAR1MAOAMAOBKDM1A | |
| SCHEMBL2277181 | 0.77 | GRIA1 (0.42) | SIGMAR1MAOAMAOBKDM1A | |
| SCHEMBL8454090 | 0.75 | NPC1 (0.51) | NPC1RAB9AGSK3BMAOAMAOB | |
| SCHEMBL8449274 | 0.74 | RAB9A (0.43) | SIGMAR1NPC1RAB9AGSK3BCA1 | |
| SCHEMBL8450081 | 0.74 | NPC1 (0.37) | SIGMAR1NPC1RAB9AGSK3BMAOB |
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 |
|---|---|---|---|---|---|---|---|
| US-5976408-A | Acrylonitrile derivative, liquid crystal composition, and liquid crystal display device | CHISSO CORPORATION (JP) | 1999-11-02 | — | — | US | disclosed |
| EP-0820983-A1 | ACRYLONITRILE DERIVATIVES, LIQUID-CRYSTAL COMPOSITION, AND LIQUID-CRYSTAL DISPLAY DEVICE | CHISSO CORPORATION (JP) | 1998-01-28 | — | — | EP | disclosed |