Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 12/20 | 0.68 |
| ▸ | HSP90AB1 | P08238 | 12/20 | 0.68 |
| ▸ | ADORA3 | P0DMS8 | 7/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 7/20 | 0.45 |
| ▸ | ADORA2B | P29275 | 7/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 7/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3393056 | 0.89 | HSP90AB1 (0.69) | HSP90AA1HSP90AB1ADORA3ADORA2AADORA2B | |
| SCHEMBL14568314 | 0.89 | HSP90AA1 (0.57) | HSP90AA1HSP90AB1ADORA3ADORA2AADORA2B | |
| SCHEMBL14568318 | 0.83 | HSP90AB1 (0.49) | HSP90AA1HSP90AB1ADORA3ADORA2AADORA2B | |
| SCHEMBL3396045 | 0.81 | HSP90AB1 (1.00) | HSP90AA1HSP90AB1ADORA2A | |
| SCHEMBL14568296 | 0.81 | HSP90AA1 (0.63) | HSP90AA1HSP90AB1ADORA2AADORA1 | |
| SCHEMBL14567912 | 0.80 | HSP90AA1 (0.48) | HSP90AA1HSP90AB1ADORA3ADORA2AADORA2B | |
| SCHEMBL3392377 | 0.78 | HSP90AB1 (0.68) | HSP90AA1HSP90AB1ADORA3ADORA2AADORA2B | |
| SCHEMBL14567905 | 0.77 | HSP90AA1 (0.43) | HSP90AA1HSP90AB1ADORA3ADORA2AADORA2B | |
| SCHEMBL14567907 | 0.77 | HSP90AB1 (0.54) | HSP90AA1HSP90AB1ADORA3ADORA2AADORA2B | |
| SCHEMBL3389634 | 0.76 | HSP90AB1 (0.69) | HSP90AA1HSP90AB1ADORA3ADORA2AADORA2B |
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-2007035963-A2 | ANTI-TUMOR METHODS USING MULTI DRUG RESISTANCE INDEPENDENT SYNTHETIC HSP90 INHIBITORS | CONFORMA THERAPEUTICS CORPORATION (US) | 2007-03-29 | — | — | WO | disclosed |