Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 17/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 17/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 11/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 7/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.41 |
| ▸ | NAT1 | P18440 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 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 | |
|---|---|---|---|---|
| SCHEMBL8977697 | 0.67 | SLC6A2 (0.43) | SLC6A2SLC6A3SLC6A4CYP2D6KCNH2 | |
| SCHEMBL25262561 | 0.65 | SLC6A2 (0.68) | SLC6A2SLC6A3SLC6A4CYP2D6KCNH2 | |
| SCHEMBL26017598 | 0.65 | SLC6A2 (0.56) | SLC6A2SLC6A3SLC6A4CYP2D6KCNH2 | |
| SCHEMBL2844239 | 0.64 | SLC6A2 (0.44) | SLC6A2SLC6A3SLC6A4CYP2D6KCNH2 | |
| Hydrochloric Acid SCHEMBL25268867 | 0.63 | SLC6A2 (0.66) | SLC6A2SLC6A3SLC6A4CYP2D6KCNH2 | |
| SCHEMBL27332932 | 0.62 | SLC6A2 (0.46) | SLC6A2SLC6A3SLC6A4CYP2D6KCNH2 | |
| SCHEMBL11381861 | 0.61 | SLC6A2 (0.45) | SLC6A2SLC6A3SLC6A4CYP2D6KCNH2 | |
| SCHEMBL22411087 | 0.61 | MAP2K1 (0.48) | SLC6A2SLC6A3SLC6A4CYP2D6KCNH2 | |
| SCHEMBL9870878 | 0.61 | SLC6A2 (0.58) | SLC6A2SLC6A3SLC6A4CYP2D6KCNH2 | |
| SCHEMBL9275640 | 0.61 | SLC6A2 (0.44) | SLC6A2SLC6A3SLC6A4CYP2D6KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0378308-B1 | Acrylate fungicides | AGREVO UK LTD (GB) | 1996-04-10 | — | — | EP | disclosed |