Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 15/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.44 |
| ▸ | WNT1 | P04628 | 1/20 | 0.40 |
| ▸ | CLK2 | P49760 | 1/20 | 0.40 |
| ▸ | CLK3 | P49761 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29675876 | 1.00 | ACACB (0.49) | ACACBMAPK1WNT1CLK2CLK3 | |
| SCHEMBL29676091 | 0.94 | ACACB (0.52) | ACACBMAPK1 | |
| SCHEMBL29675718 | 0.94 | ACACB (0.52) | ACACBMAPK1 | |
| SCHEMBL29676386 | 0.83 | HRH4 (0.44) | ACACBMAPK1 | |
| SCHEMBL29675604 | 0.82 | PIK3CA (0.52) | ACACBMAPK1 | |
| SCHEMBL29675797 | 0.77 | ACACB (0.49) | ACACBMAPK1 | |
| SCHEMBL29675578 | 0.73 | NPC1 (0.44) | ACACB | |
| SCHEMBL29676371 | 0.72 | CTSA (0.44) | ACACBMAPK1WNT1GSK3BDYRK1A | |
| SCHEMBL20950150 | 0.72 | PIK3CA (0.60) | WNT1CLK2CLK3GSK3BDYRK1A | |
| SCHEMBL29676226 | 0.71 | ACACB (0.45) | ACACBMAPK1 |
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-108617166-B | Protein kinase inhibitor benzolactam compounds | 大冢制药株式会社 | 2022-05-17 | — | — | CN | claimed |