Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 15/20 | 0.55 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.41 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.40 |
| ▸ | TRAP1 | Q12931 | 2/20 | 0.40 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.40 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.37 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | CDK4 | P11802 | 1/20 | 0.36 |
| ▸ | CCND1 | P24385 | 1/20 | 0.36 |
| ▸ | CCND2 | P30279 | 1/20 | 0.36 |
| ▸ | CCND3 | P30281 | 1/20 | 0.36 |
| ▸ | WEE1 | P30291 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3391730 | 0.81 | HSP90AA1 (0.77) | HSP90AA1TLR7HSP90AB1TRAP1HSP90B1 | |
| SCHEMBL6027699 | 0.79 | HSP90AA1 (0.49) | HSP90AA1TLR7HSP90AB1TRAP1HSP90B1 | |
| SCHEMBL6027695 | 0.79 | HSP90AA1 (0.59) | HSP90AA1TLR7HSP90AB1TRAP1HSP90B1 | |
| SCHEMBL3389600 | 0.71 | HSP90AA1 (1.00) | HSP90AA1HSP90AB1TRAP1HSP90B1 | |
| SCHEMBL3396845 | 0.70 | HSP90AA1 (0.67) | HSP90AA1TLR7HSP90AB1TRAP1HSP90B1 | |
| SCHEMBL5546339 | 0.69 | HSP90AA1 (0.56) | HSP90AA1HSP90AB1TRAP1HSP90B1 | |
| SCHEMBL13539445 | 0.69 | HSP90AA1 (0.63) | HSP90AA1TLR7HSP90AB1TRAP1HSP90B1 | |
| SCHEMBL313239 | 0.68 | HSP90AA1 (0.64) | HSP90AA1TLR7HSP90AB1TRAP1HSP90B1 | |
| SCHEMBL3389690 | 0.68 | HSP90AA1 (0.61) | HSP90AA1TLR7HSP90AB1TRAP1HSP90B1 | |
| SCHEMBL13539613 | 0.67 | HSP90AA1 (0.56) | HSP90AA1TLR7HSP90AB1TRAP1HSP90B1 |
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-1670802-A2 | NOVEL HETEROCYCLIC COMPOUNDS AS HSP90-INHIBITORS | Conforma Therapeutic Corporation (US) | 2006-06-21 | — | — | EP | disclosed |
| WO-2005028434-A2 | NOVEL HETEROCYCLIC COMPOUNDS AS HSP90-INHIBITORS | CONFORMA THERAPEUTICS CORPORATION (US) | 2005-03-31 | — | — | WO | disclosed |