Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.40 |
| ▸ | OXTR | P30559 | 1/20 | 0.38 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.38 |
| ▸ | SPHK1 | Q9NYA1 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 2/20 | 0.36 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | GBA1 | P04062 | 1/20 | 0.36 |
| ▸ | UGCG | Q16739 | 1/20 | 0.36 |
| ▸ | GBA2 | Q9HCG7 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4578608 | 1.00 | GRM2 (0.42) | GRM2ESR2OXTRAVPR1ASPHK1 | |
| SCHEMBL4820116 | 0.99 | ESR2 (0.41) | GRM2ESR2OXTRAVPR1ASPHK1 | |
| SCHEMBL8754394 | 0.99 | ESR2 (0.41) | GRM2ESR2OXTRAVPR1ASPHK1 | |
| SCHEMBL4578617 | 0.86 | GRM2 (0.38) | GRM2SPHK1MAPTGAACYP2C9 | |
| SCHEMBL4820112 | 0.85 | CTSS (0.38) | GRM2MAPTGAAACHECYP2C9 | |
| SCHEMBL8754404 | 0.85 | CTSS (0.38) | GRM2MAPTGAAACHECYP2C9 | |
| SCHEMBL9405935 | 0.83 | MAPT (0.36) | GRM2ESR2SPHK1MAPTGAA | |
| SCHEMBL9405940 | 0.83 | MAPT (0.36) | GRM2ESR2SPHK1MAPTGAA | |
| SCHEMBL9406168 | 0.83 | MAPT (0.36) | GRM2ESR2SPHK1MAPTGAA | |
| SCHEMBL9406097 | 0.83 | MAPT (0.36) | GRM2ESR2SPHK1MAPTGAA |
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-7357964-B2 | Liquid-crystalline vinyl ketone derivatives and their polymers | CHISSO CORPORATION (JP) | 2008-04-15 | — | — | US | disclosed |
| US-20050012070-A1 | Liquid-crystalline vinyl ketone derivatives and their polymers | JNC PETROCHEMICAL CORPORATION (JP) | 2005-01-20 | — | — | US | disclosed |