Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 20/20 | 0.71 |
| ▸ | HSP90AB1 | P08238 | 13/20 | 0.71 |
| ▸ | CDC37 | Q16543 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL12304521 | 1.00 | HSP90AA1 (0.71) | HSP90AA1HSP90AB1CDC37 | |
| SCHEMBL12304632 | 0.96 | HSP90AA1 (0.65) | HSP90AA1HSP90AB1CDC37 | |
| SCHEMBL12304633 | 0.96 | HSP90AA1 (0.65) | HSP90AA1HSP90AB1CDC37 | |
| SCHEMBL12304529 | 0.96 | HSP90AA1 (0.78) | HSP90AA1HSP90AB1CDC37 | |
| SCHEMBL12304517 | 0.96 | HSP90AA1 (0.78) | HSP90AA1HSP90AB1CDC37 | |
| SCHEMBL12304551 | 0.93 | HSP90AA1 (0.67) | HSP90AA1HSP90AB1CDC37 | |
| SCHEMBL12304544 | 0.93 | HSP90AA1 (0.67) | HSP90AA1HSP90AB1CDC37 | |
| SCHEMBL16139325 | 0.93 | HSP90AA1 (0.66) | HSP90AA1HSP90AB1 | |
| SCHEMBL18534309 | 0.92 | HSP90AA1 (0.65) | HSP90AA1HSP90AB1 | |
| SCHEMBL12304526 | 0.92 | HSP90AA1 (0.78) | HSP90AA1HSP90AB1 |
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 |