Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 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 | |
|---|---|---|---|---|
| SCHEMBL205843 | 0.91 | ROCK2 (0.38) | ROCK2ALOX12EPHX1 | |
| SCHEMBL8963331 | 0.89 | ROCK2 (0.38) | ROCK2ALOX12EPHX1 | |
| Perchlorate SCHEMBL9676819 | 0.83 | ROCK2 (0.35) | ROCK2ALOX12EPHX1 | |
| Perchlorate SCHEMBL9676816 | 0.81 | ROCK2 (0.33) | ROCK2ALOX12EPHX1 | |
| SCHEMBL29584884 | 0.80 | SIGMAR1 (0.35) | ROCK2ALOX12EPHX1 | |
| SCHEMBL3929841 | 0.80 | SIGMAR1 (0.35) | ROCK2ALOX12EPHX1 | |
| SCHEMBL12015428 | 0.80 | HPGD (0.40) | ROCK2ALOX12EPHX1 | |
| SCHEMBL8960858 | 0.79 | ROCK2 (0.38) | ROCK2 | |
| SCHEMBL8960493 | 0.78 | ABCB1 (0.35) | ROCK2 | |
| SCHEMBL8961009 | 0.78 | ROCK2 (0.34) | ROCK2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5516944-A | ENANTIOMORPHS WITH PHOSPHINE GROUPS FOR FORMING METAL COMPLEXES | HOFFMANN-LA ROCHE INC. (US) | 1996-05-14 | — | — | US | disclosed |
| US-5508438-A | Phosphorus compounds | HOFFMANN-LA ROCHE INC. (US) | 1996-04-16 | — | — | US | disclosed |