Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | THRB | P10828 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | ESR1 | P03372 | 2/20 | 0.45 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.45 |
| ▸ | CHUK | O15111 | 1/20 | 0.43 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.43 |
| ▸ | JAK2 | O60674 | 1/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.43 |
| ▸ | PRKCG | P05129 | 1/20 | 0.43 |
| ▸ | CDK1 | P06493 | 1/20 | 0.43 |
| ▸ | PIM1 | P11309 | 1/20 | 0.43 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.43 |
| ▸ | CDK2 | P24941 | 1/20 | 0.43 |
| ▸ | AKT1 | P31749 | 1/20 | 0.43 |
| ▸ | AKT2 | P31751 | 1/20 | 0.43 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.43 |
| ▸ | BLK | P51451 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29955818 | 1.00 | GAA (0.49) | GAAALDH1A1THRBMAPTNPSR1 | |
| SCHEMBL29957059 | 1.00 | GAA (0.49) | GAAALDH1A1THRBMAPTNPSR1 | |
| SCHEMBL29956845 | 0.98 | MAPT (0.50) | GAAALDH1A1THRBMAPTNPSR1 | |
| SCHEMBL3318133 | 0.93 | KDM4E (0.45) | GAAALDH1A1THRBMAPTNPSR1 | |
| SCHEMBL3317396 | 0.88 | MAPT (0.48) | GAAALDH1A1THRBMAPTNPSR1 | |
| SCHEMBL9946008 | 0.84 | KDM4E (0.43) | GAAALDH1A1THRBMAPTNPSR1 | |
| SCHEMBL3594529 | 0.83 | S1PR3 (0.44) | ALDH1A1MAPTESR1S1PR3CHUK | |
| SCHEMBL3533988 | 0.83 | S1PR3 (0.44) | ALDH1A1MAPTESR1S1PR3CHUK | |
| SCHEMBL29956366 | 0.83 | S1PR3 (0.44) | ALDH1A1THRBMAPTESR1S1PR3 | |
| SCHEMBL29955403 | 0.83 | S1PR3 (0.44) | ALDH1A1THRBMAPTESR1S1PR3 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |