Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 6/20 | 0.48 |
| ▸ | DHODH | Q02127 | 2/20 | 0.46 |
| ▸ | PARP1 | P09874 | 2/20 | 0.46 |
| ▸ | TBK1 | Q9UHD2 | 5/20 | 0.44 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.44 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8079568 | 0.88 | ACHE (0.46) | ACHEDHODHPARP1TBK1CHEK2 | |
| SCHEMBL8817564 | 0.85 | ACHE (0.44) | ACHEDHODHPARP1TBK1IKBKE | |
| SCHEMBL8814784 | 0.84 | ACHE (0.45) | ACHECHEK2ADORA2AADORA1ADORA3 | |
| SCHEMBL8818630 | 0.83 | CHEK2 (0.41) | ACHECHEK2 | |
| SCHEMBL8816985 | 0.83 | ACHE (0.52) | ACHEDHODHPARP1TBK1CHEK2 | |
| SCHEMBL8817108 | 0.81 | ACHE (0.48) | ACHEDHODHPARP1ADORA2AADORA1 | |
| SCHEMBL8818782 | 0.79 | KDM4E (0.35) | ACHEDHODHPARP1CHEK2 | |
| SCHEMBL8816605 | 0.79 | ACHE (0.52) | ACHEDHODHPARP1ADORA2AADORA1 | |
| SCHEMBL8817571 | 0.79 | ACHE (0.52) | ACHEDHODHPARP1ADORA2AADORA1 | |
| SCHEMBL8814893 | 0.78 | ACHE (0.51) | ACHEDHODHPARP1ADORA2AADORA1 |
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-1997031635-A1 | METHODS OF TREATING OR PREVENTING SLEEP APNEA | ELI LILLY AND COMPANY (US) | 1997-09-04 | — | — | WO | disclosed |