Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 9/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 8/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 6/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.35 |
| ▸ | TRPV4 | Q9HBA0 | 4/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | IDH1 | O75874 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | F11 | P03951 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7604665 | 0.87 | NOS2 (0.39) | NOS2SLC6A4CYP2D6SLC6A2KCNH2 | |
| SCHEMBL6981734 | 0.82 | SLC6A4 (0.40) | NOS2SLC6A4CYP2D6SLC6A2KCNH2 | |
| SCHEMBL6491319 | 0.78 | NOS2 (0.64) | NOS2SLC6A4CYP2D6SLC6A2KCNH2 | |
| SCHEMBL6489165 | 0.76 | NOS2 (0.50) | NOS2SLC6A4CYP2D6SLC6A2KCNH2 | |
| SCHEMBL6492130 | 0.75 | NOS2 (0.49) | NOS2SLC6A4CYP2D6SLC6A2KCNH2 | |
| SCHEMBL7604530 | 0.74 | NOS2 (0.43) | NOS2SLC6A4CYP2D6SLC6A2KCNH2 | |
| Oxalic Acid SCHEMBL6491241 | 0.73 | NOS2 (0.69) | NOS2SLC6A4CYP2D6SLC6A2KCNH2 | |
| SCHEMBL7604472 | 0.72 | NOS2 (0.43) | NOS2SLC6A4CYP2D6SLC6A2KCNH2 | |
| SCHEMBL6503984 | 0.70 | NOS2 (0.49) | NOS2SLC6A4CYP2D6SLC6A2KCNH2 | |
| SCHEMBL7602580 | 0.70 | CYP2D6 (0.40) | 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 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 |