Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 17/20 | 0.48 |
| ▸ | HMOX1 | P09601 | 1/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL14334926 | 0.87 | ROCK2 (0.46) | ROCK2 | |
| SCHEMBL14334914 | 0.86 | NAMPT (0.45) | HMOX1NAMPT | |
| SCHEMBL14334120 | 0.82 | ROCK2 (0.48) | ROCK2 | |
| SCHEMBL14334239 | 0.81 | ROCK2 (0.50) | ROCK2 | |
| SCHEMBL14335160 | 0.80 | PIK3CD (0.47) | — | |
| SCHEMBL23458839 | 0.74 | ROCK2 (0.53) | ROCK2 | |
| SCHEMBL10564699 | 0.74 | HRH3 (0.44) | ROCK2 | |
| SCHEMBL20646781 | 0.73 | RAB9A (0.48) | ROCK2 | |
| SCHEMBL20646783 | 0.73 | RAB9A (0.48) | ROCK2 | |
| SCHEMBL14334929 | 0.73 | KDM5A (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012176123-A1 | 3 - IMIDAZOLYL- INDOLES FOR THE TREATMENT OF PROLIFERATIVE DISEASES | NOVARTIS AG (CH) | 2012-12-27 | — | — | WO | disclosed |