Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.50 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.46 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.45 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.44 |
| ▸ | BRS3 | P32247 | 1/20 | 0.43 |
| ▸ | DAO | P14920 | 4/20 | 0.43 |
| ▸ | KDM5A | P29375 | 1/20 | 0.43 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 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 | |
|---|---|---|---|---|
| SCHEMBL10566942 | 0.89 | HRH3 (0.49) | TAAR1PDE10AGPR84AOC3BRS3 | |
| SCHEMBL10565636 | 0.89 | HRH3 (0.53) | PDE10AGPR84AOC3DAOKDM5B | |
| SCHEMBL10565813 | 0.85 | AOC3 (0.62) | TAAR1PDE10AAOC3BRS3DAO | |
| SCHEMBL10569707 | 0.81 | ESR1 (0.50) | TAAR1GPR84BACE1 | |
| SCHEMBL10569187 | 0.78 | DAO (0.50) | TAAR1DAO | |
| SCHEMBL226272 | 0.77 | HRH1 (0.55) | TAAR1PDE10AGPR84AOC3BRS3 | |
| SCHEMBL224617 | 0.77 | AOC3 (0.73) | TAAR1PDE10AGPR84AOC3BRS3 | |
| SCHEMBL17283466 | 0.72 | DAO (0.53) | TAAR1GPR84DAOKCNH2 | |
| SCHEMBL10566495 | 0.72 | IGF1R (0.47) | GPR84NPC1RAB9A | |
| SCHEMBL6111174 | 0.71 | RAB9A (0.49) | TAAR1PDE10ADAONPC1RAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4798843-A | HYPOTENSIVE AGENTS | SMITHKLINE BECKMAN CORPORATION (US) | 1989-01-17 | — | — | US | claimed |
| EP-0302603-A1 | Dopamine-beta-hydroxylase inhibitors | SMITHKLINE BEECHAM CORPORATION (US) | 1989-02-08 | — | — | EP | disclosed |
| US-4798843-A | HYPOTENSIVE AGENTS | SMITHKLINE BECKMAN CORPORATION (US) | 1989-01-17 | — | — | US | disclosed |