Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.58 |
| ▸ | HTT | P42858 | 1/20 | 0.58 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.57 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.56 |
| ▸ | MEN1 | O00255 | 5/20 | 0.56 |
| ▸ | NPC1 | O15118 | 2/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 2/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | ATM | Q13315 | 1/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL6289035 | 0.88 | HPGD (0.58) | HPGDHTTROCK2ROCK1KMT2A | |
| SCHEMBL6290073 | 0.87 | HPGD (0.70) | HPGDHTTKMT2AMEN1NPC1 | |
| SCHEMBL7495080 | 0.86 | ROCK2 (0.59) | HPGDHTTROCK2ROCK1KMT2A | |
| SCHEMBL2936345 | 0.86 | KMT2A (0.60) | HPGDHTTROCK2ROCK1KMT2A | |
| SCHEMBL13853507 | 0.83 | HIF1A (0.56) | HPGDHTTROCK2ROCK1KMT2A | |
| SCHEMBL7318332 | 0.79 | ALDH1A1 (0.56) | HPGDHTTROCK2ROCK1KMT2A | |
| SCHEMBL18901363 | 0.78 | ALDH1A1 (0.56) | HTTKMT2AMEN1NPC1NPSR1 | |
| SCHEMBL7000552 | 0.78 | KDM4E (0.69) | KMT2AMEN1ALDH1A1GAAATM | |
| SCHEMBL5963101 | 0.77 | KMT2A (0.65) | KMT2AMEN1ALDH1A1HIF1AATM | |
| SCHEMBL20496911 | 0.77 | QPCT (0.54) | ROCK2ROCK1KMT2AMEN1ALDH1A1 |
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-6867200-B1 | (Hetero)aryl-bicyclic heteroaryl derivatives, their preparation and their use as protease inhibitors | AXYS PHARMACEUTICALS, INC. (US) | 2005-03-15 | — | — | US | disclosed |
| CN-1344256-A | (Hetero) aryl-bicyclic heteroaryl derivatives, their prepn. and their use as protease inhibitors | AXYS PHARM INC (US) | 2002-04-10 | — | — | CN | disclosed |