Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 9/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 7/20 | 0.57 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.47 |
| ▸ | CNR1 | P21554 | 1/20 | 0.47 |
| ▸ | CNR2 | P34972 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7557832 | 0.96 | CYP2D6 (0.57) | CYP2D6KCNH2PDK2MAPK1 | |
| SCHEMBL10235907 | 0.85 | CYP2D6 (0.62) | CYP2D6KCNH2CNR1CNR2 | |
| SCHEMBL7552344 | 0.84 | FFAR1 (0.55) | CNR1CNR2 | |
| SCHEMBL611282 | 0.84 | CYP2D6 (0.55) | CYP2D6KCNH2CNR1CNR2 | |
| SCHEMBL4568886 | 0.83 | CYP2D6 (0.67) | CYP2D6KCNH2CNR1CNR2MAPK1 | |
| SCHEMBL2207909 | 0.82 | CYP2D6 (0.56) | CYP2D6KCNH2MAPK1 | |
| SCHEMBL7557375 | 0.82 | CNR1 (0.55) | CYP2D6KCNH2PDK2CNR1CNR2 | |
| SCHEMBL29818840 | 0.82 | CYP2D6 (0.56) | CYP2D6KCNH2MAPK1 | |
| SCHEMBL7556540 | 0.80 | FFAR1 (0.56) | — | |
| SCHEMBL13959280 | 0.79 | ACHE (0.56) | CYP2D6KCNH2 |
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-1219631-A1 | ANTIANDROGEN AGENTS | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2002-07-03 | — | — | EP | disclosed |