Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 15/20 | 0.49 |
| ▸ | HSP90AB1 | P08238 | 8/20 | 0.35 |
| ▸ | AMY1A | P0DUB6 | 2/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.34 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL461325 | 1.00 | HSP90AA1 (0.49) | HSP90AA1HSP90AB1AMY1APDE10APRKCQ | |
| SCHEMBL461822 | 0.90 | HSP90AA1 (0.42) | HSP90AA1HSP90AB1AMY1APRKCQ | |
| SCHEMBL461821 | 0.90 | HSP90AA1 (0.42) | HSP90AA1HSP90AB1AMY1APRKCQ | |
| SCHEMBL1076054 | 0.87 | HSP90AA1 (0.36) | HSP90AA1HSP90AB1AMY1APRKCQ | |
| SCHEMBL463010 | 0.86 | HSP90AA1 (0.66) | HSP90AA1HSP90AB1 | |
| SCHEMBL463009 | 0.86 | HSP90AA1 (0.66) | HSP90AA1HSP90AB1 | |
| SCHEMBL2181661 | 0.85 | HSP90AA1 (0.36) | HSP90AA1AMY1APRKCQ | |
| SCHEMBL1076728 | 0.85 | AMY1A (0.35) | HSP90AA1AMY1APDE10APRKCQ | |
| SCHEMBL383558 | 0.83 | AR (0.36) | HSP90AA1AMY1APDE10A | |
| SCHEMBL1078057 | 0.83 | HSP90AA1 (0.47) | HSP90AA1AMY1APRKCQ |
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-2408762-A1 | HSP90 INHIBITING INDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING SAME AND USE THEREOF | SANOFI (FR) | 2012-01-25 | — | — | EP | disclosed |
| WO-2010106290-A1 | HSP90 INHIBITING INDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING SAME AND USE THEREOF | SANOFI-AVENTIS (FR) | 2010-09-23 | — | — | WO | disclosed |