Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 8/20 | 0.42 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.40 |
| ▸ | FYN | P06241 | 1/20 | 0.40 |
| ▸ | DHODH | Q02127 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | MTOR | P42345 | 1/20 | 0.38 |
| ▸ | MAPKAPK5 | Q8IW41 | 1/20 | 0.37 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TTK | P33981 | 2/20 | 0.36 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | TAB1 | Q15750 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24105034 | 1.00 | IDO1 (0.42) | IDO1FGFR1FYNDHODHMAPT | |
| SCHEMBL24105254 | 0.90 | FYN (0.39) | IDO1FYNDHODHMAPTPIK3CA | |
| SCHEMBL30371633 | 0.89 | IDO1 (0.41) | IDO1FYNPIK3CAMTORMAPKAPK5 | |
| SCHEMBL24105256 | 0.89 | IDO1 (0.41) | IDO1FYNPIK3CAMTORMAPKAPK5 | |
| SCHEMBL30168164 | 0.88 | FYN (0.52) | IDO1FYNMAPKAPK5TTK | |
| SCHEMBL24105240 | 0.88 | FYN (0.52) | IDO1FYNMAPKAPK5TTK | |
| SCHEMBL30372085 | 0.85 | MAPKAPK5 (0.46) | IDO1FYNPIK3CAMTORMAPKAPK5 | |
| SCHEMBL24105258 | 0.85 | MAPKAPK5 (0.46) | IDO1FYNPIK3CAMTORMAPKAPK5 | |
| SCHEMBL24105262 | 0.82 | PTK6 (0.45) | IDO1FYNPIK3CAMTORMAPKAPK5 | |
| SCHEMBL29106533 | 0.82 | BACE1 (0.43) | MAPTPIK3CAMTORNPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-115667264-A | Novel imidazo-pyrazine derivatives | 豪夫迈·罗氏有限公司 | 2023-01-31 | — | — | CN | disclosed |