Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.41 |
| ▸ | AGTR2 | P50052 | 2/20 | 0.41 |
| ▸ | DHODH | Q02127 | 1/20 | 0.41 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.40 |
| ▸ | BRS3 | P32247 | 2/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8504620 | 0.87 | BRS3 (0.54) | AGTR1AGTR2DHODHBRS3 | |
| SCHEMBL8501923 | 0.82 | AGTR1 (0.50) | AGTR1AGTR2LTB4R2BRS3 | |
| SCHEMBL9118013 | 0.82 | AGTR1 (0.47) | AGTR1AGTR2DHODH | |
| SCHEMBL8780462 | 0.74 | TLR8 (0.41) | PDE10A | |
| SCHEMBL9759625 | 0.74 | ALDH1A1 (0.62) | LTB4R2 | |
| SCHEMBL8675220 | 0.74 | KDM4E (0.44) | PDE10A | |
| SCHEMBL7835618 | 0.71 | BRS3 (0.52) | AGTR1AGTR2DHODHLTB4R2BRS3 | |
| SCHEMBL7835619 | 0.70 | PDE4A (0.41) | AGTR1AGTR2DHODHBRS3PDE10A | |
| SCHEMBL9654571 | 0.69 | AGTR1 (0.56) | AGTR1AGTR2DHODHLTB4R2 | |
| SCHEMBL28408449 | 0.68 | PTGS1 (0.66) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-4346974-A | — | — | None | — | — | JP | disclosed |
| JP-H04346974-A | NOVEL NITROGENOUS BICYCLIC DERIVATIVES, THEIR PRODUCTION, RESULTED NOVEL INTERMEDIATES, THEIR USE AS MEDICAMENTS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME | ROUSSEL UCLAF | 1992-12-02 | — | — | JP | disclosed |