Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | GSK3B | P49841 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | NSD2 | O96028 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | UBE2N | P61088 | 1/20 | 0.37 |
| ▸ | MLYCD | O95822 | 1/20 | 0.37 |
| ▸ | NSD3 | Q9BZ95 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8454926 | 0.80 | GRIA1 (0.46) | RAB9ANPC1 | |
| SCHEMBL8454090 | 0.79 | NPC1 (0.51) | RAB9AGSK3BNPC1CA1CA2 | |
| SCHEMBL21793705 | 0.75 | GSK3B (0.53) | RAB9AGSK3BNPC1CA1CA2 | |
| SCHEMBL7446955 | 0.75 | CA1 (0.55) | RAB9AGSK3BNPC1CA1CA2 | |
| SCHEMBL8452965 | 0.74 | SIGMAR1 (0.42) | RAB9AGSK3BNPC1CA1CA2 | |
| SCHEMBL8452968 | 0.74 | SIGMAR1 (0.42) | RAB9AGSK3BNPC1CA1CA2 | |
| SCHEMBL9667067 | 0.74 | CA1 (0.47) | RAB9AGSK3BNPC1CA1CA2 | |
| SCHEMBL8185953 | 0.74 | CYP2A6 (0.44) | RAB9AGSK3BNPC1CA1CA2 | |
| SCHEMBL8450081 | 0.72 | NPC1 (0.37) | RAB9AGSK3BNPC1CA1CA2 | |
| SCHEMBL8450089 | 0.72 | NPC1 (0.37) | RAB9AGSK3BNPC1CA1CA2 |
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 |