Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
| ▸ | BUB1 | O43683 | 1/20 | 0.33 |
| ▸ | SPR | P35270 | 5/20 | 0.32 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.31 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22902720 | 1.00 | ALDH1A1 (0.34) | ALDH1A1PIK3R1PIK3CABUB1SPR | |
| SCHEMBL22902683 | 0.87 | JAK1 (0.38) | ALDH1A1PIK3R1PIK3CABUB1 | |
| SCHEMBL22902495 | 0.83 | PIK3R1 (0.38) | PIK3R1PIK3CABUB1SPRAAK1 | |
| SCHEMBL29737066 | 0.81 | JAK1 (0.33) | ALDH1A1SPR | |
| SCHEMBL24590580 | 0.81 | JAK1 (0.33) | ALDH1A1SPR | |
| SCHEMBL18818279 | 0.80 | HCAR1 (0.41) | — | |
| SCHEMBL18289981 | 0.80 | HCAR1 (0.41) | — | |
| SCHEMBL18285718 | 0.80 | HCAR1 (0.41) | — | |
| SCHEMBL30111817 | 0.80 | HCAR1 (0.41) | — | |
| SCHEMBL22902921 | 0.76 | BTK (0.44) | — |
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-2021011428-A1 | HETEROCYCLIC KINASE INHIBITORS | GB005, INC. (US) | 2021-01-21 | — | — | WO | disclosed |