Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 20/20 | 0.65 |
| ▸ | HSP90AB1 | P08238 | 12/20 | 0.65 |
| ▸ | CDC37 | Q16543 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL12304635 | 0.95 | HSP90AA1 (0.59) | HSP90AA1HSP90AB1CDC37 | |
| SCHEMBL12304519 | 0.95 | HSP90AA1 (0.65) | HSP90AA1HSP90AB1CDC37 | |
| SCHEMBL12304553 | 0.93 | HSP90AA1 (0.58) | HSP90AA1HSP90AB1CDC37 | |
| SCHEMBL12304571 | 0.92 | HSP90AA1 (0.77) | HSP90AA1HSP90AB1CDC37 | |
| SCHEMBL12304520 | 0.92 | HSP90AA1 (0.58) | HSP90AA1HSP90AB1CDC37 | |
| SCHEMBL12304613 | 0.91 | HSP90AA1 (0.61) | HSP90AA1HSP90AB1CDC37 | |
| SCHEMBL12304521 | 0.89 | HSP90AA1 (0.71) | HSP90AA1HSP90AB1CDC37 | |
| SCHEMBL12304545 | 0.89 | HSP90AA1 (0.71) | HSP90AA1HSP90AB1CDC37 | |
| SCHEMBL12304631 | 0.89 | HSP90AA1 (0.56) | HSP90AA1HSP90AB1CDC37 | |
| SCHEMBL12304659 | 0.88 | HSP90AA1 (0.53) | HSP90AA1HSP90AB1CDC37 |
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 |
|---|---|---|---|---|---|---|---|
| US-8017780-B1 | Therapeutic compounds and uses thereof | MYREXIS, INC. (US) | 2011-09-13 | — | — | US | disclosed |
| US-8017780-B1 | Therapeutic compounds and uses thereof | MYREXIS, INC. (US) | 2011-09-13 | — | — | US | disclosed |