Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 5/20 | 0.56 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.52 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.49 |
| ▸ | NPY1R | P25929 | 2/20 | 0.47 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.44 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.44 |
| ▸ | PSMB2 | P49721 | 1/20 | 0.44 |
| ▸ | HRH1 | P35367 | 2/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.44 |
| ▸ | HRH2 | P25021 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11448671 | 0.90 | LTA4H (0.68) | LTA4HCHEK2AURKBNPY1R | |
| SCHEMBL7335065 | 0.89 | LTA4H (0.54) | LTA4HCHEK2 | |
| Hydrochloric Acid SCHEMBL7328923 | 0.88 | LTA4H (0.53) | LTA4HCHEK2 | |
| Hydrochloric Acid SCHEMBL7435059 | 0.87 | LTA4H (0.55) | LTA4HCHEK2PSMB1PSMB5PSMB2 | |
| SCHEMBL5706378 | 0.86 | CHEK2 (0.55) | LTA4HCHEK2AURKBHRH1HRH2 | |
| SCHEMBL7446075 | 0.86 | LTA4H (0.75) | LTA4HAURKBNPY1R | |
| SCHEMBL11447734 | 0.86 | LTA4H (0.67) | LTA4HNPY1RHRH3 | |
| SCHEMBL6004777 | 0.85 | CHEK2 (0.54) | LTA4HCHEK2AURKBHRH1HRH2 | |
| Hydrochloric Acid SCHEMBL6560096 | 0.85 | CHEK2 (0.54) | LTA4HCHEK2AURKBHRH1HRH2 | |
| SCHEMBL11713224 | 0.85 | CHEK2 (0.55) | LTA4HCHEK2AURKBPSMB1PSMB5 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0763022-A1 | PHENOXYALKYL SUBSTITUTED PIPERIDINES, PYRROLIDINES, MORPHOLINES AND THIOMORPHOLINES AS CALCIUM CHANNEL ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1997-03-19 | — | — | EP | disclosed |
| WO-1995033723-A1 | PHENOXYALKYL SUBSTITUTED PIPERIDINES, PYRROLIDINES, MORPHOLINES AND THIOMORPHOLINES AS CALCIUM CHANNEL ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1995-12-14 | — | — | WO | disclosed |