Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TMIGD3 | P0DMS9 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.37 |
| ▸ | GHSR | Q92847 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | SERPINA3 | P01011 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 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 | |
|---|---|---|---|---|
| SCHEMBL19575685 | 0.91 | HDAC1 (0.42) | LMNAALOX15TMIGD3ADORA2AADORA1 | |
| SCHEMBL19575684 | 0.88 | HDAC1 (0.42) | LMNAALOX15TMIGD3ADORA2AADORA1 | |
| SCHEMBL20972809 | 0.86 | LMNA (0.42) | LMNACA1CA2CA4CA9 | |
| SCHEMBL20946421 | 0.85 | HDAC1 (0.39) | ALOX15CA1CA2CA4CA9 | |
| SCHEMBL19575486 | 0.85 | LMNA (0.41) | LMNAALOX15GAAAURKARPS6KB1 | |
| SCHEMBL19575501 | 0.84 | HDAC1 (0.45) | TMIGD3ADORA2AADORA1HDAC1HDAC6 | |
| SCHEMBL20974159 | 0.83 | CYP19A1 (0.41) | LMNAALOX15GAACA1CA2 | |
| SCHEMBL26229890 | 0.82 | HDAC1 (0.40) | LMNATMIGD3ADORA2AADORA1AURKA | |
| SCHEMBL20973055 | 0.81 | NT5E (0.45) | CA1CA2CA4CA9HDAC1 | |
| SCHEMBL19575382 | 0.81 | HDAC1 (0.43) | TMIGD3ADORA2AADORA1CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3452477-B1 | ADENINE DERIVATIVES AS PROTEIN KINASE INHIBITORS | B C I PHARMA (BE) | 2023-09-13 | — | — | EP | disclosed |