Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 10/20 | 0.43 |
| ▸ | NAMPT | P43490 | 5/20 | 0.40 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7656595 | 0.86 | ROCK2 (0.39) | ROCK2NAMPT | |
| SCHEMBL6295077 | 0.84 | ROCK2 (0.58) | ROCK2 | |
| Hydrochloric Acid SCHEMBL6299497 | 0.83 | ROCK2 (0.57) | ROCK2 | |
| SCHEMBL7993332 | 0.83 | ROCK2 (0.45) | ROCK2NAMPT | |
| SCHEMBL7653872 | 0.82 | ROCK2 (0.38) | ROCK2 | |
| SCHEMBL7659472 | 0.81 | ROCK2 (0.43) | ROCK2 | |
| SCHEMBL7659848 | 0.77 | ROCK2 (0.39) | ROCK2NAMPTL3MBTL3 | |
| SCHEMBL7656812 | 0.76 | CYP26A1 (0.38) | ROCK2 | |
| SCHEMBL7655629 | 0.76 | ROCK2 (0.50) | ROCK2 | |
| SCHEMBL6806888 | 0.75 | ROCK2 (0.38) | 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-6492378-B1 | Substituted isoquinoline derivatives and their use as anticonvulsivants | SMITHKLINE BEECHAM P.L.C. (GB) | 2002-12-10 | — | — | US | claimed |
| US-6492378-B1 | Substituted isoquinoline derivatives and their use as anticonvulsivants | SMITHKLINE BEECHAM P.L.C. (GB) | 2002-12-10 | — | — | US | disclosed |