Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | POLB | P06746 | 2/20 | 0.58 |
| ▸ | IDO1 | P14902 | 1/20 | 0.58 |
| ▸ | MLKL | Q8NB16 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.49 |
| ▸ | MASP2 | O00187 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.48 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.48 |
| ▸ | ALPL | P05186 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | SCN10A | Q9Y5Y9 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL12737571 | 0.85 | TAAR1 (0.68) | TAAR1ALDH1A1POLBIDO1MLKL | |
| SCHEMBL8330903 | 0.85 | TAAR1 (0.68) | TAAR1ALDH1A1POLBIDO1MLKL | |
| SCHEMBL524001 | 0.85 | TAAR1 (0.68) | TAAR1ALDH1A1POLBIDO1MLKL | |
| Hydrochloric Acid SCHEMBL2452918 | 0.84 | TAAR1 (0.66) | TAAR1ALDH1A1POLBIDO1MLKL | |
| Hydrochloric Acid SCHEMBL5207771 | 0.82 | TAAR1 (0.64) | TAAR1ALDH1A1POLBIDO1MLKL | |
| SCHEMBL23181664 | 0.81 | POLB (0.61) | TAAR1ALDH1A1POLBIDO1MLKL | |
| SCHEMBL21180833 | 0.81 | POLB (0.61) | TAAR1ALDH1A1POLBIDO1MLKL | |
| SCHEMBL85832 | 0.81 | ALDH1A1 (0.66) | TAAR1ALDH1A1POLBIDO1MLKL | |
| SCHEMBL30665026 | 0.81 | ALDH1A1 (0.66) | TAAR1ALDH1A1POLBIDO1MLKL | |
| SCHEMBL2147079 | 0.81 | ALDH1A1 (0.66) | TAAR1ALDH1A1POLBIDO1MLKL |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5733882-A | Retroviral protease inhibitors | SMITHKLINE BEECHAM CORPORATION (US) | 1998-03-31 | — | — | US | disclosed |
| EP-0602069-A4 | RETROVIRAL PROTEASE INHIBITORS. | SMITHKLINE BEECHAM CORP (US) | 1995-05-03 | — | — | EP | disclosed |
| EP-0602069-A1 | RETROVIRAL PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 1994-06-22 | — | — | EP | disclosed |
| WO-1993002057-A1 | RETROVIRAL PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 1993-02-04 | — | — | WO | disclosed |