Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 14/20 | 0.38 |
| ▸ | HSP90AB1 | P08238 | 14/20 | 0.38 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.37 |
| ▸ | TRAP1 | Q12931 | 1/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.34 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.32 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.32 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL184460 | 0.86 | HSP90AA1 (0.40) | HSP90AA1HSP90AB1HSP90B1TRAP1CHRNA7 | |
| SCHEMBL1852028 | 0.72 | HSP90AA1 (0.49) | HSP90AA1HSP90AB1HSP90B1TRAP1 | |
| SCHEMBL14123937 | 0.69 | HSP90AB1 (0.64) | HSP90AA1HSP90AB1HSP90B1TRAP1 | |
| SCHEMBL1304291 | 0.68 | HSP90AA1 (0.54) | HSP90AA1HSP90AB1 | |
| SCHEMBL31296853 | 0.67 | HSP90AA1 (0.56) | HSP90AA1HSP90AB1HSP90B1TRAP1 | |
| SCHEMBL1148585 | 0.67 | HSP90AA1 (0.58) | HSP90AA1HSP90AB1 | |
| SCHEMBL2268041 | 0.65 | HSP90AB1 (0.57) | HSP90AA1HSP90AB1HSP90B1TRAP1 | |
| SCHEMBL3665914 | 0.65 | KEAP1 (0.38) | HSP90AA1HSP90AB1CHRNA7CACNA1H | |
| SCHEMBL1305171 | 0.65 | HSP90AA1 (0.69) | HSP90AA1HSP90AB1 | |
| SCHEMBL184281 | 0.64 | CHRNA7 (0.36) | HSP90AA1HSP90AB1CHRNA7CACNA1H |
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 |
|---|---|---|---|---|---|---|---|
| EP-2155694-A2 | TRIAZINONE AND DIAZINONE DERIVATIVES USEFUL AS HSP90 INHIBITORS | Synta Pharmaceuticals Corporation (US) | 2010-02-24 | — | — | EP | disclosed |
| WO-2008118391-A2 | TRIAZINONE AND DIAZINONE DERIVATIVES USEFUL AS HSP90 INHIBITORS | SYNTA PHARMACEUTICALS CORP. (US) | 2008-10-02 | — | — | WO | disclosed |