Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 7/20 | 0.47 |
| ▸ | THRB | P10828 | 6/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.41 |
| ▸ | GGPS1 | O95749 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10809631 | 0.95 | THRA (0.46) | THRATHRBCYP2D6KCNH2PLA2G4B | |
| SCHEMBL10810100 | 0.95 | THRA (0.48) | THRATHRBCYP2D6KCNH2PLA2G4B | |
| SCHEMBL10803876 | 0.93 | THRA (0.47) | THRATHRBCYP2D6KCNH2PLA2G4B | |
| SCHEMBL10808082 | 0.91 | CYP2D6 (0.46) | THRATHRBCYP2D6KCNH2PLA2G4B | |
| SCHEMBL10808155 | 0.89 | THRA (0.46) | THRATHRBPLA2G4B | |
| SCHEMBL10805761 | 0.89 | THRA (0.46) | THRATHRBPLA2G4B | |
| SCHEMBL10812512 | 0.88 | THRA (0.46) | THRATHRBCYP2D6KCNH2PLA2G4B | |
| SCHEMBL10809407 | 0.88 | PPARA (0.47) | THRATHRBCYP2D6KCNH2 | |
| SCHEMBL10806483 | 0.88 | PPARA (0.47) | THRATHRBCYP2D6KCNH2 | |
| SCHEMBL10804916 | 0.88 | CYP2D6 (0.43) | CYP2D6KCNH2PLA2G4BGGPS1MAPK1 |
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-4640913-A | Phosphocholine derivatives having antihypertensive action | AMERICAN CYANAMID COMPANY (US) | 1987-02-03 | — | — | US | disclosed |