Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 20/20 | 0.55 |
| ▸ | HSP90AB1 | P08238 | 20/20 | 0.55 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.38 |
| ▸ | TRAP1 | Q12931 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4786259 | 0.88 | HSP90AA1 (0.48) | HSP90AA1HSP90AB1 | |
| Hydrochloric Acid SCHEMBL4787381 | 0.87 | HSP90AA1 (0.47) | HSP90AA1HSP90AB1 | |
| SCHEMBL1304307 | 0.83 | HSP90AA1 (0.71) | HSP90AA1HSP90AB1HSP90B1TRAP1 | |
| SCHEMBL4786852 | 0.82 | HSP90AA1 (0.78) | HSP90AA1HSP90AB1 | |
| Hydrochloric Acid SCHEMBL1304868 | 0.82 | HSP90AA1 (0.70) | HSP90AA1HSP90AB1HSP90B1TRAP1 | |
| SCHEMBL12060284 | 0.79 | HSP90AA1 (0.63) | HSP90AA1HSP90AB1HSP90B1TRAP1 | |
| SCHEMBL1304392 | 0.79 | HSP90AA1 (0.67) | HSP90AA1HSP90AB1 | |
| Hydrochloric Acid SCHEMBL1304249 | 0.78 | HSP90AA1 (0.66) | HSP90AA1HSP90AB1 | |
| SCHEMBL4743521 | 0.77 | HSP90AA1 (0.57) | HSP90AA1HSP90AB1HSP90B1TRAP1 | |
| SCHEMBL14777477 | 0.77 | HSP90AA1 (0.57) | HSP90AA1HSP90AB1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008103353-A1 | TRIAZOLE COMPOUNDS THAT MODULATE HSP90 ACTIVITY | SYNTA PHARMACEUTICALS CORP. (US) | 2008-08-28 | — | — | WO | claimed |
| WO-2008103353-A1 | TRIAZOLE COMPOUNDS THAT MODULATE HSP90 ACTIVITY | SYNTA PHARMACEUTICALS CORP. (US) | 2008-08-28 | — | — | WO | disclosed |