Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 3/20 | 0.61 |
| ▸ | NOS3 | P29474 | 2/20 | 0.61 |
| ▸ | NOS2 | P35228 | 2/20 | 0.61 |
| ▸ | GGT1 | P19440 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL2237559 | 0.77 | NOS3 (0.55) | NOS1NOS3NOS2 | |
| SCHEMBL5966652 | 0.77 | NOS3 (0.55) | NOS1NOS3NOS2 | |
| SCHEMBL5271958 | 0.76 | NOS1 (1.00) | NOS1NOS3NOS2 | |
| SCHEMBL1975770 | 0.76 | NOS3 (0.63) | NOS1NOS3NOS2 | |
| SCHEMBL5966618 | 0.73 | NOS3 (0.45) | NOS1NOS3NOS2GGT1 | |
| SCHEMBL5966589 | 0.73 | NOS3 (0.45) | NOS1NOS3NOS2GGT1 | |
| SCHEMBL5966591 | 0.73 | NOS3 (0.45) | NOS1NOS3NOS2GGT1 | |
| Acetic Acid SCHEMBL29403856 | 0.73 | NOS2 (0.91) | NOS1NOS3NOS2 | |
| SCHEMBL13060032 | 0.73 | GGT1 (0.32) | GGT1 | |
| Hydrochloric Acid SCHEMBL7365150 | 0.72 | NOS1 (0.70) | NOS1NOS3NOS2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1244460-B8 | USE OF DIPYRIDINIUM COMPOUNDS FOR TREATING A DISEASE CHARACTERIZED BY PROLIFERATING CELLS CONTAINING NITRIC OXIDE SYNTHASE | UNIV DUKE (US) | 2010-05-19 | — | — | EP | disclosed |
| EP-1244460-A4 | TREATMENTS BASED ON DISCOVERY THAT NITRIC OXIDE SYNTHASE IS A PARAQUAT DIAPHORASE | UNIV DUKE (US) | 2004-10-06 | — | — | EP | disclosed |
| EP-1244460-A1 | TREATMENTS BASED ON DISCOVERY THAT NITRIC OXIDE SYNTHASE IS A PARAQUAT DIAPHORASE | DUKE UNIVERSITY (US) | 2002-10-02 | — | — | EP | disclosed |
| WO-2001028568-A1 | TREATMENTS BASED ON DISCOVERY THAT NITRIC OXIDE SYNTHASE IS A PARAQUAT DIAPHORASE | DUKE UNIVERSITY (US) | 2001-04-26 | — | — | WO | disclosed |