Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR2 | P50052 | 4/20 | 0.36 |
| ▸ | MMP2 | P08253 | 3/20 | 0.36 |
| ▸ | ANPEP | P15144 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | ACE | P12821 | 4/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.31 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 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 | |
|---|---|---|---|---|
| SCHEMBL22980663 | 1.00 | AGTR2 (0.36) | AGTR2MMP2ANPEPALDH1A1GAA | |
| SCHEMBL1249702 | 0.88 | ALDH1A1 (0.35) | ALDH1A1GAAKCNA3CHRM1CASP1 | |
| SCHEMBL1249707 | 0.88 | ALDH1A1 (0.35) | ALDH1A1GAAKCNA3CHRM1CASP1 | |
| SCHEMBL1249705 | 0.88 | ALDH1A1 (0.35) | ALDH1A1GAAKCNA3CHRM1CASP1 | |
| SCHEMBL3898037 | 0.84 | BTK (0.39) | AGTR2MMP2ANPEPKCNA3CHRM1 | |
| SCHEMBL29697301 | 0.84 | BTK (0.39) | AGTR2MMP2ANPEPKCNA3CHRM1 | |
| SCHEMBL3967827 | 0.84 | AGTR2 (0.38) | AGTR2MMP2ANPEPALDH1A1GAA | |
| SCHEMBL1248545 | 0.82 | ALDH1A1 (0.34) | AGTR2MMP2ANPEPALDH1A1GAA | |
| SCHEMBL1248544 | 0.82 | ALDH1A1 (0.34) | AGTR2MMP2ANPEPALDH1A1GAA | |
| SCHEMBL1248542 | 0.82 | ALDH1A1 (0.34) | AGTR2MMP2ANPEPALDH1A1GAA |
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-4010080-A1 | HETEROCYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF CANCER | Artios Pharma Limited (GB) | 2022-06-15 | — | — | EP | disclosed |