Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 17/20 | 0.53 |
| ▸ | HSP90AB1 | P08238 | 12/20 | 0.53 |
| ▸ | HSP90B1 | P14625 | 5/20 | 0.46 |
| ▸ | TRAP1 | Q12931 | 5/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27641134 | 0.85 | HSP90AA1 (0.48) | HSP90AA1HSP90AB1HSP90B1TRAP1 | |
| SCHEMBL27661738 | 0.79 | HSP90AA1 (0.52) | HSP90AA1HSP90AB1HSP90B1TRAP1CA1 | |
| SCHEMBL3396057 | 0.79 | HSP90AA1 (0.71) | HSP90AA1HSP90AB1HSP90B1TRAP1 | |
| SCHEMBL13539449 | 0.73 | HSP90AA1 (0.56) | HSP90AA1HSP90AB1HSP90B1TRAP1 | |
| SCHEMBL3396339 | 0.71 | HSP90AA1 (0.55) | HSP90AA1HSP90AB1HSP90B1TRAP1 | |
| SCHEMBL27831830 | 0.70 | TRAP1 (0.42) | HSP90AA1HSP90B1TRAP1 | |
| SCHEMBL28787805 | 0.69 | TRAP1 (0.36) | HSP90AA1HSP90B1TRAP1 | |
| SCHEMBL3396299 | 0.69 | HSP90AB1 (1.00) | HSP90AA1HSP90AB1HSP90B1TRAP1 | |
| SCHEMBL4268613 | 0.69 | HSP90AA1 (0.64) | HSP90AA1HSP90AB1HSP90B1TRAP1 | |
| SCHEMBL3395828 | 0.69 | HSP90AB1 (0.80) | HSP90AA1HSP90AB1HSP90B1TRAP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101906106-A | New heterogeneous ring compound as the HSP90-inhibitor | CONFORMA THERAPEUTICS CORP | 2010-12-08 | — | — | CN | disclosed |
| CN-1882589-B | Novel heterocyclic compounds as HSP 90-inhibitors | CONFORMA THERAPEUTICS CORP | 2010-06-09 | — | — | CN | disclosed |
| CN-1882589-A | Novel heterocyclic compounds as HSP 90-inhibitors | CONFORMA THERAPEUTICS CORP (US) | 2006-12-20 | — | — | CN | disclosed |