Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 5/20 | 0.36 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.35 |
| ▸ | NOS3 | P29474 | 2/20 | 0.34 |
| ▸ | NOS1 | P29475 | 2/20 | 0.34 |
| ▸ | NOS2 | P35228 | 2/20 | 0.34 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.33 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.33 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10347668 | 1.00 | CYP2C9 (0.55) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL3791147 | 0.85 | MEN1 (0.52) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL1457321 | 0.85 | MEN1 (0.52) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL10348069 | 0.84 | MEN1 (0.51) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL16345263 | 0.83 | CYP3A4 (0.48) | CYP2C9MAPK1ESR2CYP3A4TSHR | |
| SCHEMBL4803899 | 0.82 | CYP2C9 (0.69) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL4803893 | 0.82 | CYP2C9 (0.69) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL10347974 | 0.81 | MEN1 (0.49) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL10532002 | 0.81 | MEN1 (0.49) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL10348559 | 0.81 | MEN1 (0.49) | CYP2C9ALDH1A1LMNAMAPTMEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0227004-B1 | LIQUID CRYSTALLINE ETHANE DERIVATIVES, THEIR PREPARATION AND THE LIQUID CRYSTAL COMPOSITIONS CONTAINING SAME | Wojskowa Akademia Techniczna im. Jaroslawa Dabrowskiego (PL) | 1990-04-11 | — | — | EP | claimed |