Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.54 |
| ▸ | EGFR | P00533 | 3/20 | 0.49 |
| ▸ | ERBB2 | P04626 | 3/20 | 0.49 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | GFER | P55789 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.45 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.45 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.45 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.44 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL136054 | 0.94 | SLC7A5 (0.55) | SLC7A5EGFRERBB2GLAALDH1A1 | |
| SCHEMBL29700723 | 0.94 | SLC7A5 (0.55) | SLC7A5EGFRERBB2GLAALDH1A1 | |
| SCHEMBL1560308 | 0.89 | SLC7A5 (0.65) | SLC7A5ALDH1A1GAAGFERKDM4E | |
| SCHEMBL3421266 | 0.88 | SLC7A5 (0.54) | SLC7A5EGFRERBB2ALDH1A1GAA | |
| SCHEMBL78652 | 0.87 | AKR1B1 (0.58) | EGFRERBB2GAAKDM4EFFAR1 | |
| Methane SCHEMBL10697726 | 0.85 | AKR1B1 (0.56) | EGFRERBB2GAAKDM4EFFAR1 | |
| Hydrochloric Acid SCHEMBL1374336 | 0.85 | AKR1B1 (0.56) | EGFRERBB2GAAKDM4EFFAR1 | |
| SCHEMBL30267713 | 0.83 | EGFR (0.47) | SLC7A5EGFRERBB2GLAKDM4E | |
| SCHEMBL17111341 | 0.83 | EGFR (0.47) | SLC7A5EGFRERBB2GLAKDM4E | |
| SCHEMBL12400239 | 0.81 | SLC7A5 (0.68) | SLC7A5ALDH1A1GAAGFERKDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1079821-A4 | PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORP (US) | 2001-08-29 | — | — | EP | disclosed |
| EP-1079821-A1 | PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2001-03-07 | — | — | EP | disclosed |
| WO-1999059570-A1 | PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 1999-11-25 | — | — | WO | disclosed |