Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | MKNK1 | Q9BUB5 | 3/20 | 0.42 |
| ▸ | MKNK2 | Q9HBH9 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.40 |
| ▸ | PDE4A | P27815 | 2/20 | 0.40 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.40 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.40 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.38 |
| ▸ | PARP3 | Q9Y6F1 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.37 |
| ▸ | RORC | P51449 | 1/20 | 0.37 |
| ▸ | IRAK4 | Q9NWZ3 | 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 | |
|---|---|---|---|---|
| SCHEMBL29951654 | 0.89 | MKNK1 (0.49) | ALDH1A1MKNK1MKNK2TSHRPDE4B | |
| SCHEMBL29956766 | 0.86 | GRIK1 (0.42) | ALDH1A1TSHRPDE4BPDE4APDE4C | |
| SCHEMBL29956100 | 0.82 | KAT2B (0.50) | ALDH1A1TSHRAOX1RORC | |
| SCHEMBL29954837 | 0.80 | NPC1 (0.44) | ALDH1A1MKNK1MKNK2TSHRPDE4B | |
| SCHEMBL29957292 | 0.78 | KAT2B (0.52) | ALDH1A1TSHRPDE4BPDE4APDE4C | |
| SCHEMBL31565679 | 0.78 | PARP1 (0.42) | MKNK1MKNK2PDE4BPDE4APDE4C | |
| SCHEMBL6171075 | 0.78 | ALDH1A1 (0.65) | ALDH1A1TSHRPDE4BPDE4APDE4C | |
| SCHEMBL29951801 | 0.78 | ALDH1A1 (0.65) | ALDH1A1TSHRPDE4BPDE4APDE4C | |
| SCHEMBL29957120 | 0.78 | ALDH1A1 (0.42) | ALDH1A1TSHRPDE4BAOX1RORC | |
| SCHEMBL22713946 | 0.76 | ALDH1A1 (0.68) | ALDH1A1TSHRPDE4BPDE4APDE4C |
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 |