Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 15/20 | 0.61 |
| ▸ | SLC6A4 | P31645 | 13/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 11/20 | 0.61 |
| ▸ | SLC6A2 | P23975 | 11/20 | 0.61 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | BCL2A1 | Q16548 | 1/20 | 0.34 |
| ▸ | KHK | P50053 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6502590 | 1.00 | NOS2 (0.61) | NOS2SLC6A4CYP2D6SLC6A2S1PR1 | |
| Fumaric Acid SCHEMBL6491560 | 0.92 | NOS2 (0.58) | NOS2SLC6A4CYP2D6SLC6A2S1PR1 | |
| Fumaric Acid SCHEMBL6491937 | 0.92 | NOS2 (0.58) | NOS2SLC6A4CYP2D6SLC6A2S1PR1 | |
| SCHEMBL6491496 | 0.83 | NOS2 (0.65) | NOS2SLC6A4CYP2D6SLC6A2S1PR1 | |
| SCHEMBL6498984 | 0.77 | NOS2 (0.62) | NOS2SLC6A4CYP2D6SLC6A2KCNH2 | |
| SCHEMBL5651211 | 0.76 | NOS2 (0.58) | NOS2SLC6A4CYP2D6SLC6A2S1PR1 | |
| Fumaric Acid SCHEMBL6504713 | 0.76 | NOS2 (0.61) | NOS2SLC6A4CYP2D6SLC6A2S1PR1 | |
| Fumaric Acid SCHEMBL6504718 | 0.76 | NOS2 (0.61) | NOS2SLC6A4CYP2D6SLC6A2S1PR1 | |
| SCHEMBL6489634 | 0.76 | NOS2 (0.50) | NOS2SLC6A4CYP2D6SLC6A2KCNH2 | |
| SCHEMBL231999 | 0.76 | SLC6A4 (1.00) | NOS2SLC6A4CYP2D6SLC6A2KCNH2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1263711-B1 | NOVEL USE OF PHENYLHETEROALKYLAMINE DERIVATIVES | ASTRAZENECA AB (SE) | 2004-12-15 | — | — | EP | claimed |