Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 6/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GPR139 | Q6DWJ6 | 3/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.33 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.32 |
| ▸ | BRAF | P15056 | 1/20 | 0.32 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL6857277 | 0.89 | ROCK2 (0.36) | ROCK2 | |
| SCHEMBL2370285 | 0.87 | ROCK2 (0.39) | ROCK2SLC6A3 | |
| SCHEMBL6857675 | 0.84 | ROCK2 (0.46) | ROCK2 | |
| SCHEMBL2370407 | 0.80 | TRPV1 (0.47) | ROCK2 | |
| SCHEMBL12301416 | 0.79 | CYP2C9 (0.47) | ROCK2 | |
| SCHEMBL14562492 | 0.79 | KDM4C (0.44) | KDM4CKAT2B | |
| SCHEMBL2371286 | 0.78 | CYP2C9 (0.44) | ROCK2 | |
| SCHEMBL2370978 | 0.78 | RIPK1 (0.41) | ROCK2 | |
| SCHEMBL2371290 | 0.75 | TACR3 (0.40) | ROCK2POLB | |
| SCHEMBL2370469 | 0.74 | AKT1 (0.45) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011110183-A1 | AZAISOQUINOLINONE DERIVATIVES AS NK3 ANTAGONISTS | H. LUNDBECK A/S (DK) | 2011-09-15 | — | — | WO | disclosed |