Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 2/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 3/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.38 |
| ▸ | MMP13 | P45452 | 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 | |
|---|---|---|---|---|
| SCHEMBL5244355 | 0.94 | PDE10A (0.40) | ROCK2ROCK1HPGDLMNAGAA | |
| SCHEMBL5245898 | 0.91 | PPARG (0.40) | ROCK2ROCK1BRD4PDE10A | |
| SCHEMBL5244336 | 0.91 | ROCK2 (0.42) | ROCK2ROCK1BRD4PDE10A | |
| SCHEMBL5248700 | 0.91 | ROCK2 (0.41) | ROCK2ROCK1LMNAMAPTBRD4 | |
| SCHEMBL5246315 | 0.91 | HPGD (0.39) | ROCK2ROCK1HPGDLMNAGAA | |
| SCHEMBL5246767 | 0.90 | MIF (0.47) | HPGDLMNAGAABRD4 | |
| SCHEMBL5244706 | 0.88 | ROCK2 (0.40) | ROCK2ROCK1TP53BRD4PDE10A | |
| SCHEMBL5245796 | 0.88 | ROCK2 (0.44) | ROCK2ROCK1LMNAMAPT | |
| SCHEMBL5247070 | 0.87 | ROCK2 (0.41) | ROCK2ROCK1LMNABRD4 | |
| SCHEMBL5245935 | 0.87 | ROCK2 (0.41) | ROCK2ROCK1TP53BRD4PDE10A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1867331-A1 | TRIAZOLE DERIVATIVE AND THE USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2007-12-19 | — | — | EP | disclosed |