Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY6 | Q15077 | 1/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 7/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 2/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 2/20 | 0.32 |
| ▸ | DRD3 | P35462 | 2/20 | 0.32 |
| ▸ | PNMT | P11086 | 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 | |
|---|---|---|---|---|
| SCHEMBL623724 | 0.72 | TDP2 (0.39) | P2RY6ABCB1CYP2A6PTGS2CA12 | |
| SCHEMBL5139262 | 0.72 | TDP2 (0.44) | ABCB1CYP2A6PTGS2CA12CA9 | |
| SCHEMBL14043141 | 0.69 | KDM4E (0.39) | ABCB1 | |
| SCHEMBL31085054 | 0.66 | DAO (0.36) | ABCB1CYP2A6CA12CA9DRD2 | |
| SCHEMBL11619301 | 0.63 | CA12 (0.47) | CYP2A6CA12CA9 | |
| SCHEMBL31287181 | 0.62 | ABCC9 (0.36) | ABCB1PDK2 | |
| SCHEMBL11022031 | 0.62 | PNMT (0.43) | CYP2A6KDM1ACA12CA9DRD2 | |
| SCHEMBL31362085 | 0.62 | SNCA (0.42) | CYP2A6CA12CA9DRD2DRD3 | |
| SCHEMBL28398312 | 0.62 | SNCA (0.42) | CYP2A6CA12CA9DRD2DRD3 | |
| SCHEMBL29618319 | 0.60 | PNMT (0.46) | PDK2KDM1ADRD2DRD3PNMT |
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-0424125-A2 | Aralkylamine derivatives, preparation method thereof and fungicides containing the same | UBE INDUSTRIES, LTD. (JP) | 1991-04-24 | — | — | EP | disclosed |