Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 1/20 | 0.37 |
| ▸ | NAAA | Q02083 | 1/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.33 |
| ▸ | PDE2A | O00408 | 5/20 | 0.33 |
| ▸ | DHODH | Q02127 | 1/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 3/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.31 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.31 |
| ▸ | FEN1 | P39748 | 1/20 | 0.31 |
| ▸ | ABL1 | P00519 | 1/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8963179 | 1.00 | CTSK (0.37) | CTSKNAAAS1PR1EPHX2PDE2A | |
| SCHEMBL8963018 | 0.90 | EPHX2 (0.36) | S1PR1EPHX2PDE2A | |
| SCHEMBL8963026 | 0.90 | EPHX2 (0.36) | S1PR1EPHX2PDE2A | |
| SCHEMBL8962943 | 0.87 | EPHX2 (0.34) | S1PR1EPHX2PDE2A | |
| SCHEMBL23666165 | 0.85 | CTSK (0.38) | CTSKNAAAS1PR1EPHX2PDE2A | |
| SCHEMBL8962824 | 0.85 | KDM1A (0.41) | NAAAFAAHGRIN2B | |
| SCHEMBL8962831 | 0.85 | KDM1A (0.41) | NAAAFAAHGRIN2B | |
| SCHEMBL8447961 | 0.84 | CTSK (0.37) | CTSKNAAAS1PR1EPHX2PDE2A | |
| SCHEMBL8447941 | 0.84 | CTSK (0.37) | CTSKNAAAS1PR1EPHX2PDE2A | |
| SCHEMBL8447947 | 0.84 | CTSK (0.37) | CTSKNAAAS1PR1EPHX2PDE2A |
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 |