Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 5/20 | 0.40 |
| ▸ | FFAR4 | Q5NUL3 | 8/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.38 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.38 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.38 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.36 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6488402 | 0.82 | FFAR1 (0.57) | FFAR1FFAR4CYP2D6KEAP1 | |
| SCHEMBL8963029 | 0.81 | SPHK1 (0.43) | HDAC2 | |
| SCHEMBL9408368 | 0.78 | L3MBTL1 (0.40) | FFAR4HDAC2 | |
| SCHEMBL8963210 | 0.78 | SPHK1 (0.36) | HDAC2 | |
| SCHEMBL8963144 | 0.76 | SPHK1 (0.47) | HDAC2 | |
| SCHEMBL8963157 | 0.76 | SPHK1 (0.47) | HDAC2 | |
| SCHEMBL13061403 | 0.76 | FFAR4 (0.56) | FFAR1FFAR4KEAP1S1PR1S1PR3 | |
| SCHEMBL8963019 | 0.75 | HDAC2 (0.45) | HDAC2CYP2D6 | |
| SCHEMBL8963014 | 0.75 | HDAC2 (0.45) | HDAC2CYP2D6 | |
| SCHEMBL9408347 | 0.75 | SPHK1 (0.39) | FFAR4HDAC2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0559860-B1 | HALOVINYL-DERIVATIVES | HOFFMANN LA ROCHE (CH) | 1996-02-14 | — | — | EP | disclosed |
| US-5364556-A | Halovinyl-derivatives | HOFFMANN-LA ROCHE INC. (US) | 1994-11-15 | — | — | US | disclosed |
| WO-1993007234-A1 | HALOVINYL-DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 1993-04-15 | — | — | WO | disclosed |