Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 8/20 | 0.62 |
| ▸ | ACHE | P22303 | 3/20 | 0.50 |
| ▸ | MAOB | P27338 | 2/20 | 0.49 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | DRD1 | P21728 | 1/20 | 0.44 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.44 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL31538932 | 0.86 | MAOB (0.49) | TAAR1MAOBSIRT2 | |
| SCHEMBL20825574 | 0.86 | MAOB (0.49) | TAAR1MAOBSIRT2 | |
| SCHEMBL327462 | 0.85 | PPARA (0.46) | TAAR1AOC3 | |
| SCHEMBL28032739 | 0.84 | TAAR1 (0.58) | TAAR1ACHEMAOB | |
| SCHEMBL18183459 | 0.83 | TAAR1 (0.57) | TAAR1ACHEMAOBDRD2DRD1 | |
| SCHEMBL11806920 | 0.83 | FAAH (0.42) | TAAR1DRD2AOC3SIRT2 | |
| SCHEMBL8048495 | 0.83 | CYP4F2 (0.61) | TAAR1AOC3SIRT2 | |
| SCHEMBL8048492 | 0.83 | NR1H4 (0.46) | TAAR1AOC3SIRT2 | |
| SCHEMBL146849 | 0.81 | TAAR1 (0.68) | TAAR1ACHEMAOBDRD2DRD1 | |
| SCHEMBL30820845 | 0.81 | TAAR1 (0.68) | TAAR1ACHEMAOBDRD2DRD1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001055117-A1 | NOVEL ISOQUINOLINE DERIVATIVES, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | LES LABORATOIRES SERVIER (FR) | 2001-08-02 | — | — | WO | disclosed |
| US-5231181-A | PROCESS FOR THE PREPARATION OF (8AS,12AS,13AS)-DECAHYDROISOQUINO ((2,1-G) (1,6)-NAPHTHYRIDIN-8-ONE DERIVATIVES | SYNTEX (U.S.A.) INC. (US) | 1993-07-27 | — | — | US | disclosed |
| EP-0505183-A2 | Process for the preparation of (8aS,12aS,13aS)-decahydroisoquino[2,1-g][1,6]-naphthyridin-8-one derivatives | SYNTEX (U.S.A.) INC. (US) | 1992-09-23 | — | — | EP | disclosed |