Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 19/20 | 0.59 |
| ▸ | TRAP1 | Q12931 | 3/20 | 0.53 |
| ▸ | HSP90B1 | P14625 | 2/20 | 0.53 |
| ▸ | HSP90AB1 | P08238 | 5/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL3801566 | 0.91 | HSP90AA1 (0.70) | HSP90AA1TRAP1HSP90B1HSP90AB1 | |
| SCHEMBL3795008 | 0.88 | HSP90AA1 (0.57) | HSP90AA1TRAP1HSP90B1HSP90AB1 | |
| SCHEMBL3797850 | 0.86 | HSP90AA1 (0.54) | HSP90AA1TRAP1HSP90B1HSP90AB1 | |
| SCHEMBL3801644 | 0.85 | HSP90AA1 (0.47) | HSP90AA1TRAP1HSP90B1HSP90AB1 | |
| SCHEMBL3799848 | 0.85 | HSP90AA1 (0.61) | HSP90AA1TRAP1HSP90B1HSP90AB1 | |
| SCHEMBL3803933 | 0.82 | HSP90AA1 (0.71) | HSP90AA1TRAP1HSP90B1HSP90AB1 | |
| SCHEMBL13539617 | 0.81 | HSP90AA1 (0.79) | HSP90AA1TRAP1HSP90B1HSP90AB1 | |
| SCHEMBL14568025 | 0.80 | HSP90AA1 (0.68) | HSP90AA1TRAP1HSP90B1HSP90AB1 | |
| SCHEMBL10233831 | 0.79 | HSP90AA1 (0.70) | HSP90AA1TRAP1HSP90B1HSP90AB1 | |
| SCHEMBL3795551 | 0.79 | HSP90AA1 (0.52) | HSP90AA1TRAP1HSP90B1HSP90AB1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010117425-A1 | CERTAIN SUBSTITUTED PYRIMIDINES, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS FOR THEIR USE | BIOGEN IDEC MA INC. (US) | 2010-10-14 | — | — | WO | disclosed |