Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLD1 | Q13393 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.38 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | HTR7 | P34969 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6830554 | 0.74 | HTR2A (0.42) | ALDH1A1CYP3A4USP2CYP2D6MEN1 | |
| Hydrochloric Acid SCHEMBL5874289 | 0.70 | SLC6A2 (0.40) | PLD1SLC6A2GRIN1GRIN2AGRIN2B | |
| Hydrochloric Acid SCHEMBL5874197 | 0.70 | SLC6A2 (0.40) | PLD1SLC6A2GRIN1GRIN2AGRIN2B | |
| SCHEMBL29658709 | 0.70 | SLC6A2 (0.45) | PLD1SLC6A2GRIN1GRIN2AGRIN2B | |
| SCHEMBL21989897 | 0.70 | SLC6A2 (0.45) | PLD1SLC6A2GRIN1GRIN2AGRIN2B | |
| SCHEMBL4477246 | 0.69 | ALDH1A1 (0.45) | PLD1SLC6A2GRIN1GRIN2AGRIN2B | |
| SCHEMBL20129631 | 0.68 | PLD1 (0.54) | PLD1GRIN1GRIN2AGRIN2BALDH1A1 | |
| SCHEMBL26153822 | 0.68 | SLC6A2 (0.45) | PLD1SLC6A2GRIN1GRIN2AGRIN2B | |
| SCHEMBL26153825 | 0.68 | SLC6A2 (0.45) | PLD1SLC6A2GRIN1GRIN2AGRIN2B | |
| SCHEMBL16795106 | 0.68 | SLC6A2 (0.45) | PLD1SLC6A2GRIN1GRIN2AGRIN2B |
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-1373247-A2 | SPIROISOQUINOLINE COMPOUNDS, METHODS FOR THEIR PREPARATION AND INTERMEDIATES THEREOF | TANABE SEIYAKU CO., LTD. (JP) | 2004-01-02 | — | — | EP | disclosed |
| WO-2002079189-A2 | SPIROISOQUINOLINE COMPOUNDS, METHODS FOR THEIR PREPARATION AND INTERMEDIATES | TANABE SEIYAKU CO., LTD. (JP) | 2002-10-10 | — | — | WO | disclosed |