Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 3/20 | 0.41 |
| ▸ | NOS3 | P29474 | 2/20 | 0.41 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.38 |
| ▸ | NCF1 | P14598 | 2/20 | 0.35 |
| ▸ | PLAU | P00749 | 1/20 | 0.35 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.33 |
| ▸ | XIAP | P98170 | 1/20 | 0.33 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 3/20 | 0.31 |
| ▸ | PGK1 | P00558 | 1/20 | 0.31 |
| ▸ | PGK2 | P07205 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | IDH1 | O75874 | 1/20 | 0.30 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.30 |
| ▸ | NOS1 | P29475 | 1/20 | 0.30 |
| ▸ | PI4KA | P42356 | 1/20 | 0.30 |
| ▸ | PI4K2B | Q8TCG2 | 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 | |
|---|---|---|---|---|
| SCHEMBL15091255 | 0.78 | NOS2 (0.46) | NOS2NOS3ASIC3NCF1PLAU | |
| SCHEMBL30464720 | 0.78 | NOS2 (0.46) | NOS2NOS3ASIC3NCF1PLAU | |
| SCHEMBL23021115 | 0.78 | NOS2 (0.46) | NOS2NOS3ASIC3NCF1PLAU | |
| SCHEMBL30695913 | 0.73 | NOS2 (0.50) | NOS2NOS3ASIC3NCF1PLAU | |
| SCHEMBL77583 | 0.73 | NOS2 (0.50) | NOS2NOS3ASIC3NCF1PLAU | |
| SCHEMBL181081 | 0.73 | P2RX7 (0.47) | NOS2NOS3ASIC3BACE1PGK1 | |
| SCHEMBL30531687 | 0.73 | P2RX7 (0.47) | NOS2NOS3ASIC3BACE1PGK1 | |
| Hydrochloric Acid SCHEMBL9985132 | 0.71 | NOS2 (0.48) | NOS2NOS3ASIC3NCF1PLAU | |
| SCHEMBL22828437 | 0.70 | NOS3 (0.46) | NOS2NOS3ASIC3NCF1PLAU | |
| SCHEMBL64599 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023247977-A1 | DEUTERATED PICARUTRAZOX DERIVATIVES AND THEIR USES | REDAG CROP PROTECTION LTD (GB) | 2023-12-28 | — | — | WO | disclosed |