Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 9/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 7/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 7/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 7/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.36 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.36 |
| ▸ | S1PR2 | O95136 | 2/20 | 0.35 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.34 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.34 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.34 |
| ▸ | P2RX2 | Q9UBL9 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6490535 | 0.80 | NOS2 (0.67) | NOS2CYP2D6SLC6A2SLC6A4KCNH2 | |
| Oxalic Acid SCHEMBL6501478 | 0.75 | NOS2 (0.71) | NOS2CYP2D6SLC6A2SLC6A4KCNH2 | |
| SCHEMBL7608216 | 0.74 | NOS2 (0.42) | NOS2CYP2D6SLC6A2SLC6A4KCNH2 | |
| SCHEMBL7604472 | 0.73 | NOS2 (0.43) | NOS2CYP2D6SLC6A2SLC6A4KCNH2 | |
| SCHEMBL1306764 | 0.69 | IDH1 (0.53) | NOS2CYP2D6SLC6A2SLC6A4KCNH2 | |
| SCHEMBL6981893 | 0.68 | NOS2 (0.52) | NOS2CYP2D6SLC6A2SLC6A4KCNH2 | |
| SCHEMBL7602580 | 0.67 | CYP2D6 (0.40) | NOS2CYP2D6SLC6A2SLC6A4KCNH2 | |
| SCHEMBL7604665 | 0.67 | NOS2 (0.39) | NOS2CYP2D6SLC6A2SLC6A4KCNH2 | |
| SCHEMBL4678021 | 0.66 | KDM4E (0.54) | NOS2CYP2D6SLC6A2SLC6A4KCNH2 | |
| SCHEMBL13358872 | 0.66 | SLC2A1 (0.37) | SLC6A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1263711-A1 | NOVEL USE OF PHENYLHETEROALKYLAMINE DERIVATIVES | AstraZeneca AB (SE) | 2002-12-11 | — | — | EP | disclosed |
| WO-2001062704-A1 | NOVEL USE OF PHENYLHETEROALKYLAMINE DERIVATIVES | ASTRAZENECA AB (SE) | 2001-08-30 | — | — | WO | disclosed |