Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGK1 | P00558 | 4/20 | 0.35 |
| ▸ | PGK2 | P07205 | 4/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5250314 | 0.81 | PGK1 (0.42) | PGK1PGK2CES2CES1TRPA1 | |
| SCHEMBL820010 | 0.75 | HDAC4 (0.52) | TRPA1 | |
| SCHEMBL7295518 | 0.75 | TSHR (0.48) | PGK1PGK2 | |
| SCHEMBL4948763 | 0.75 | PGK1 (0.40) | PGK1PGK2 | |
| SCHEMBL642404 | 0.72 | IDO1 (0.48) | — | |
| SCHEMBL2642828 | 0.71 | ADRB1 (0.38) | — | |
| SCHEMBL5843001 | 0.71 | PGK1 (0.38) | PGK1PGK2 | |
| SCHEMBL2642539 | 0.71 | MEN1 (0.52) | PGK1PGK2 | |
| SCHEMBL713815 | 0.71 | — | — | |
| SCHEMBL8723723 | 0.70 | PGK1 (0.31) | PGK1PGK2CES2CES1TRPA1 |
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-5629406-A | AMINO ACID DERIVATIVES | SANKYO COMPANY, LIMITED (JP) | 1997-05-13 | — | — | US | disclosed |
| EP-0587311-A1 | Peptides capable of inhibiting the activity of HIV protease, their preparation and their therapeutic use | SANKYO COMPANY LIMITED (JP) | 1994-03-16 | — | — | EP | disclosed |