Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 15/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 15/20 | 0.39 |
| ▸ | NOS2 | P35228 | 3/20 | 0.36 |
| ▸ | NOS3 | P29474 | 2/20 | 0.36 |
| ▸ | NOS1 | P29475 | 2/20 | 0.36 |
| ▸ | ADH1C | P00326 | 2/20 | 0.32 |
| ▸ | ADH1A | P07327 | 2/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29957507 | 0.88 | SLC6A4 (0.43) | SLC6A2SLC6A4NOS2NOS3NOS1 | |
| SCHEMBL29955016 | 0.87 | ADH1A (0.37) | ADH1CADH1A | |
| SCHEMBL29958626 | 0.83 | ADH1A (0.47) | ADH1CADH1A | |
| SCHEMBL29957653 | 0.83 | SLC6A2 (0.42) | SLC6A2SLC6A4NOS2NOS3NOS1 | |
| SCHEMBL30657708 | 0.81 | ADH1A (0.50) | ADH1CADH1A | |
| SCHEMBL23377075 | 0.79 | SLC6A4 (0.49) | SLC6A2SLC6A4NOS2NOS3NOS1 | |
| SCHEMBL255044 | 0.78 | SLC6A2 (0.49) | SLC6A2SLC6A4NOS2NOS3NOS1 | |
| SCHEMBL29951764 | 0.78 | NOS3 (0.33) | NOS2NOS3NOS1 | |
| SCHEMBL29951598 | 0.76 | SLC6A4 (0.44) | SLC6A2SLC6A4NOS2NOS3NOS1 | |
| Hydrochloric Acid SCHEMBL16673562 | 0.76 | SLC6A2 (0.47) | SLC6A2SLC6A4NOS2NOS3NOS1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |