Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAMKK1 | Q8N5S9 | 1/20 | 0.38 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 5/20 | 0.36 |
| ▸ | DRD4 | P21917 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | PDE1A | P54750 | 1/20 | 0.32 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.32 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | EPHB3 | P54753 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | JAK2 | O60674 | 1/20 | 0.31 |
| ▸ | JAK1 | P23458 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29548356 | 0.80 | PIK3CA (0.32) | CAMKK1CAMKK2 | |
| SCHEMBL29548839 | 0.80 | DRD4 (0.34) | CAMKK1CAMKK2DRD3DRD4ALDH1A1 | |
| SCHEMBL29548217 | 0.75 | ALDH1A1 (0.40) | CAMKK1CAMKK2DRD3DRD4ALDH1A1 | |
| SCHEMBL12540412 | 0.73 | CAMKK1 (0.41) | CAMKK1CAMKK2DRD3DRD4ALDH1A1 | |
| SCHEMBL29548599 | 0.73 | IRAK4 (0.35) | — | |
| SCHEMBL29548233 | 0.71 | CAMKK1 (0.36) | CAMKK1CAMKK2DRD3DRD4ALDH1A1 | |
| SCHEMBL29548929 | 0.71 | DRD4 (0.39) | CAMKK1CAMKK2DRD3DRD4ALDH1A1 | |
| SCHEMBL29548203 | 0.69 | CAMKK1 (0.38) | CAMKK1CAMKK2DRD3DRD4ALDH1A1 | |
| SCHEMBL29548244 | 0.65 | ALDH1A1 (0.34) | CAMKK1CAMKK2DRD3DRD4ALDH1A1 | |
| SCHEMBL13331631 | 0.64 | HCAR2 (0.39) | — |
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-2022070288-A1 | NITROGEN-CONTAINING BICYCLIC COMPOUND | 旭化成ファーマ株式会社 | 2022-04-07 | — | — | WO | disclosed |