Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | KIT | P10721 | 2/20 | 0.37 |
| ▸ | TRPC5 | Q9UL62 | 3/20 | 0.36 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | KDM5A | P29375 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL3376646 | 0.89 | MAPK14 (0.46) | MAPK14TP53KITTRPC5GRIN1 | |
| SCHEMBL3433244 | 0.85 | CTSA (0.40) | MAPK14TP53TGFBR1GRIN1GRIN2B | |
| SCHEMBL3433560 | 0.81 | MAPK14 (0.46) | MAPK14TP53KITTRPC5GRIN1 | |
| SCHEMBL15147687 | 0.80 | TGFBR1 (0.46) | MAPK14TP53TGFBR1KDM4EALDH1A1 | |
| SCHEMBL3433378 | 0.80 | TGFBR1 (0.51) | MAPK14KITTGFBR1GRIN1GRIN2B | |
| SCHEMBL3377364 | 0.79 | SMN1; SMN2 (0.43) | TP53 | |
| SCHEMBL3475344 | 0.77 | KIT (0.48) | MAPK14KITTRPC5GRIN1GRIN2B | |
| SCHEMBL3474070 | 0.73 | TGFBR1 (0.49) | MAPK14KITTGFBR1GRIN1GRIN2B | |
| SCHEMBL3377951 | 0.73 | MAPK14 (0.45) | MAPK14KITTRPC5GRIN1GRIN2B | |
| SCHEMBL3378965 | 0.70 | SCN5A (0.44) | TP53KDM4EALDH1A1HPGD |
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-2010053757-A1 | 2 -OXOQUINOXALIN BLOCKERS OF THE LATE SODIUM CHANNEL | GILEAD PALO ALTO, INC. (US) | 2010-05-14 | — | — | WO | claimed |