Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 13/20 | 1.00 |
| ▸ | HSP90AB1 | P08238 | 13/20 | 1.00 |
| ▸ | ERBB2 | P04626 | 6/20 | 1.00 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.52 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.51 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.51 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL1964201 | 1.00 | HSP90AA1 (1.00) | HSP90AA1HSP90AB1ERBB2HSP90B1ADORA2A | |
| SCHEMBL1964068 | 0.91 | HSP90AB1 (0.83) | HSP90AA1HSP90AB1ERBB2HSP90B1 | |
| SCHEMBL1964692 | 0.90 | HSP90AB1 (0.82) | HSP90AA1HSP90AB1ERBB2HSP90B1 | |
| SCHEMBL1966909 | 0.89 | HSP90AB1 (0.80) | HSP90AA1HSP90AB1ERBB2HSP90B1ADORA2A | |
| SCHEMBL1964710 | 0.89 | HSP90AB1 (0.80) | HSP90AA1HSP90AB1ERBB2HSP90B1 | |
| SCHEMBL5521691 | 0.89 | ERBB2 (1.00) | HSP90AA1HSP90AB1ERBB2HSP90B1ADORA2A | |
| SCHEMBL1965056 | 0.89 | HSP90AA1 (0.80) | HSP90AA1HSP90AB1ERBB2HSP90B1ADORA2A | |
| SCHEMBL1965287 | 0.89 | HSP90AA1 (0.80) | HSP90AA1HSP90AB1ERBB2HSP90B1ADORA2A | |
| SCHEMBL1965706 | 0.89 | ERBB2 (1.00) | HSP90AA1HSP90AB1ERBB2ADORA2AADORA2B | |
| SCHEMBL1963379 | 0.89 | ERBB2 (1.00) | HSP90AA1HSP90AB1ERBB2HSP90B1ADORA2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3681504-B1 | METHODS OF DETECTION USING X-RAY FLUORESCENCE | ICAGEN INC (US) | 2023-08-23 | — | — | EP | disclosed |