Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | XBP1 | P17861 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.33 |
| ▸ | HSPA5 | P11021 | 2/20 | 0.33 |
| ▸ | NR5A2 | O00482 | 1/20 | 0.33 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Tazofelone SCHEMBL380266 | 0.82 | ALDH1A1 (0.40) | ALDH1A1GAAMAPK1HTTNPSR1 | |
| Tazofelone SCHEMBL7561505 | 0.82 | ALDH1A1 (0.40) | ALDH1A1GAAMAPK1HTTNPSR1 | |
| Tazofelone SCHEMBL7562446 | 0.82 | ALDH1A1 (0.40) | ALDH1A1GAAMAPK1HTTNPSR1 | |
| SCHEMBL8933440 | 0.81 | CA2 (0.40) | ALDH1A1NPSR1PTGS2PTGS1 | |
| SCHEMBL8533710 | 0.79 | HSPA5 (0.40) | ALDH1A1GAAMAPK1HTTNPSR1 | |
| SCHEMBL8534157 | 0.78 | MAOA (0.48) | ALDH1A1GAAMAPK1HTTNPSR1 | |
| SCHEMBL8822837 | 0.74 | GAA (0.41) | ALDH1A1GAAMAPK1HTTNPSR1 | |
| SCHEMBL8537962 | 0.73 | ESRRA (0.38) | ALDH1A1HTTNPSR1CYP2C9CYP1A2 | |
| SCHEMBL8028498 | 0.70 | HSPA5 (0.55) | ALDH1A1GAAXBP1MAPK1HTT | |
| SCHEMBL29404283 | 0.70 | HSPA5 (0.55) | ALDH1A1GAAXBP1MAPK1HTT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1996022772-A1 | METHOD FOR TREATING MULTIPLE SCLEROSIS | ELI LILLY AND COMPANY (US) | 1996-08-01 | — | — | WO | disclosed |