Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 7/20 | 0.62 |
| ▸ | PPARG | P37231 | 4/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.57 |
| ▸ | CNR1 | P21554 | 1/20 | 0.55 |
| ▸ | CNR2 | P34972 | 1/20 | 0.55 |
| ▸ | GGPS1 | O95749 | 2/20 | 0.51 |
| ▸ | PTGIR | P43119 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL5257651 | 0.94 | PPARA (0.58) | PPARAPPARGCYP2D6KCNH2CNR1 | |
| SCHEMBL9266111 | 0.90 | CYP2D6 (0.58) | PPARAPPARGCYP2D6KCNH2CNR1 | |
| SCHEMBL3199103 | 0.87 | CYP2D6 (0.56) | PPARAPPARGCYP2D6KCNH2GGPS1 | |
| SCHEMBL11197529 | 0.87 | CHRM2 (0.58) | PPARAPPARGCYP2D6KCNH2PTGIR | |
| SCHEMBL3680955 | 0.87 | TSHR (0.59) | PPARACYP2D6GGPS1 | |
| SCHEMBL17509804 | 0.87 | PPARA (0.68) | PPARAPPARGCYP2D6KCNH2CNR1 | |
| SCHEMBL17509789 | 0.87 | PPARA (0.68) | PPARAPPARGCYP2D6KCNH2CNR1 | |
| SCHEMBL17509796 | 0.87 | PPARA (0.68) | PPARAPPARGCYP2D6KCNH2CNR1 | |
| SCHEMBL17509797 | 0.87 | PPARA (0.68) | PPARAPPARGCYP2D6KCNH2CNR1 | |
| SCHEMBL17509810 | 0.87 | PPARA (0.68) | PPARAPPARGCYP2D6KCNH2CNR1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5985869-A | USEFUL AS VASODILATORS, HYPOTENSIVE AGENTS, WATER DIURETICS, PLATELET AGGLUTINATION INHIBITORS | OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) | 1999-11-16 | — | — | US | disclosed |
| US-5753677-A | Benzoheterocyclic compounds | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1998-05-19 | — | — | US | disclosed |
| US-5559230-A | VASOPRESSIN ANTAGONISTS, QUINOLINES, BENZAZEPINES, VASODILATION, HYPOTENSIVE AGENTS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1996-09-24 | — | — | US | disclosed |
| EP-0450097-B1 | BENZOHETEROCYCLIC COMPOUNDS | OTSUKA PHARMA CO LTD (JP) | 1996-04-24 | — | — | EP | disclosed |
| EP-0602209-A1 | OXYTOCIN ANTAGONIST | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1994-06-22 | — | — | EP | disclosed |
| WO-1994001113-A1 | OXYTOCIN ANTAGONIST | OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) | 1994-01-20 | — | — | WO | disclosed |
| EP-0450097-A1 | BENZOHETEROCYCLIC COMPOUNDS. | OTSUKA PHARMA CO LTD (JP) | 1991-10-09 | — | — | EP | disclosed |
| WO-1991005549-A1 | BENZOHETEROCYCLIC COMPOUNDS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1991-05-02 | — | — | WO | disclosed |