Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 18/20 | 0.62 |
| ▸ | HSP90AB1 | P08238 | 18/20 | 0.62 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.53 |
| ▸ | HSP90B1 | P14625 | 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 | |
|---|---|---|---|---|
| SCHEMBL4900283 | 0.89 | HSP90AA1 (0.77) | HSP90AA1HSP90AB1ERBB2HSP90B1 | |
| SCHEMBL4897565 | 0.76 | HSP90AA1 (1.00) | HSP90AA1HSP90AB1HSP90B1 | |
| SCHEMBL1964689 | 0.74 | HSP90AA1 (1.00) | HSP90AA1HSP90AB1 | |
| Ammonia Solution, Strong SCHEMBL6352818 | 0.72 | HSP90AA1 (0.73) | HSP90AA1HSP90AB1HSP90B1 | |
| SCHEMBL5043365 | 0.71 | HSP90AA1 (1.00) | HSP90AA1HSP90AB1HSP90B1 | |
| SCHEMBL14466464 | 0.71 | HSP90AA1 (0.82) | HSP90AA1HSP90AB1 | |
| SCHEMBL3114041 | 0.71 | HSP90AA1 (0.56) | HSP90AA1HSP90AB1 | |
| SCHEMBL5514963 | 0.70 | HSP90AA1 (1.00) | HSP90AA1HSP90AB1 | |
| SCHEMBL1964277 | 0.70 | HSP90AA1 (1.00) | HSP90AA1HSP90AB1ERBB2HSP90B1 | |
| SCHEMBL6897052 | 0.69 | PPARA (0.62) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2336133-A1 | Purine analogs having HSP90-inhibiting activity | Conforma Therapeutics Corporation (US) | 2011-06-22 | — | — | EP | disclosed |