Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | PTGIR | P43119 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6510073 | 1.00 | HPGD (0.39) | HPGDL3MBTL1ALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL6508234 | 0.93 | HPGD (0.37) | HPGDL3MBTL1ALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL6514102 | 0.93 | HPGD (0.40) | HPGDL3MBTL1ALDH1A1MAPTTP53 | |
| SCHEMBL6512117 | 0.83 | CTSK (0.38) | L3MBTL1ALDH1A1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL6512111 | 0.83 | CTSK (0.38) | L3MBTL1ALDH1A1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL6513221 | 0.82 | CTSK (0.40) | L3MBTL1ALDH1A1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL6513215 | 0.82 | CTSK (0.40) | L3MBTL1ALDH1A1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL6510461 | 0.80 | ALDH1A1 (0.40) | L3MBTL1ALDH1A1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL6510466 | 0.80 | ALDH1A1 (0.40) | L3MBTL1ALDH1A1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL6509288 | 0.80 | ATM (0.35) | L3MBTL1ALDH1A1CYP1A2CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005003103-A2 | 2, 4, 6-TRI-SUBSTITUTED 6-MEMBERED HETEROCYCLES AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES | ASTRAZENECA AB (SE) | 2005-01-13 | — | — | WO | claimed |
| WO-2005003103-A2 | 2, 4, 6-TRI-SUBSTITUTED 6-MEMBERED HETEROCYCLES AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES | ASTRAZENECA AB (SE) | 2005-01-13 | — | — | WO | disclosed |