Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 7/20 | 0.40 |
| ▸ | NOS2 | P35228 | 7/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 6/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | IDH1 | O75874 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.35 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.34 |
| ▸ | F11 | P03951 | 2/20 | 0.34 |
| ▸ | KLKB1 | P03952 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.32 |
| ▸ | P2RX2 | Q9UBL9 | 1/20 | 0.32 |
| ▸ | F10 | P00742 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7608216 | 0.82 | NOS2 (0.42) | SLC6A4NOS2CYP2D6SLC6A2KCNH2 | |
| SCHEMBL7604665 | 0.81 | NOS2 (0.39) | SLC6A4NOS2CYP2D6SLC6A2KCNH2 | |
| SCHEMBL7608154 | 0.80 | CYP2D6 (0.40) | SLC6A4NOS2CYP2D6SLC6A2KCNH2 | |
| SCHEMBL6503984 | 0.78 | NOS2 (0.49) | SLC6A4NOS2CYP2D6SLC6A2KCNH2 | |
| Oxalic Acid SCHEMBL6504705 | 0.74 | NOS2 (0.53) | SLC6A4NOS2CYP2D6SLC6A2KCNH2 | |
| SCHEMBL1306764 | 0.73 | IDH1 (0.53) | SLC6A4NOS2CYP2D6SLC6A2KCNH2 | |
| SCHEMBL6504708 | 0.71 | NOS2 (0.47) | SLC6A4NOS2CYP2D6SLC6A2KCNH2 | |
| SCHEMBL6489165 | 0.70 | NOS2 (0.50) | SLC6A4NOS2CYP2D6SLC6A2KCNH2 | |
| SCHEMBL6492130 | 0.70 | NOS2 (0.49) | SLC6A4NOS2CYP2D6SLC6A2KCNH2 | |
| SCHEMBL6491319 | 0.70 | NOS2 (0.64) | SLC6A4NOS2CYP2D6SLC6A2KCNH2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2003523988-A | — | — | 2003-08-12 | — | — | JP | claimed |
| EP-1263711-A1 | NOVEL USE OF PHENYLHETEROALKYLAMINE DERIVATIVES | AstraZeneca AB (SE) | 2002-12-11 | — | — | EP | claimed |
| WO-2001062704-A1 | NOVEL USE OF PHENYLHETEROALKYLAMINE DERIVATIVES | ASTRAZENECA AB (SE) | 2001-08-30 | — | — | WO | claimed |
| 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 |