Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 4/20 | 0.60 |
| ▸ | HSP90AB1 | P08238 | 3/20 | 0.60 |
| ▸ | THRA | P10827 | 12/20 | 0.44 |
| ▸ | THRB | P10828 | 12/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | APEX1 | P27695 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | TSPO | P30536 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10948201 | 0.82 | TSHR (0.56) | HSP90AA1HSP90AB1POLBAPEX1TDP1 | |
| SCHEMBL11080912 | 0.81 | ALDH1A1 (0.45) | HSP90AA1HSP90AB1THRBBCHEACHE | |
| SCHEMBL4945325 | 0.79 | GAA (0.61) | HSP90AA1HSP90AB1THRATHRBPOLB | |
| SCHEMBL6115630 | 0.78 | POLB (0.47) | HSP90AA1HSP90AB1POLBAPEX1TDP1 | |
| SCHEMBL11076064 | 0.76 | HSP90AA1 (0.60) | HSP90AA1HSP90AB1POLBAPEX1TDP1 | |
| SCHEMBL5086740 | 0.75 | GAA (0.50) | HSP90AA1HSP90AB1POLBAPEX1TDP1 | |
| SCHEMBL487500 | 0.75 | HSP90AA1 (1.00) | HSP90AA1HSP90AB1TDP1 | |
| SCHEMBL11769359 | 0.75 | ALDH1A1 (0.62) | HSP90AA1HSP90AB1THRATHRBTDP1 | |
| SCHEMBL11084146 | 0.75 | HSP90AA1 (0.48) | HSP90AA1HSP90AB1BCHEACHE | |
| SCHEMBL5166554 | 0.75 | TRPA1 (0.59) | HSP90AA1HSP90AB1THRATHRBPOLB |
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 |
|---|---|---|---|---|---|---|---|
| US-4435397-A | ADRENERGIC BLOCKING AGENTS, 4-(3-ARYLOXY-2-HYDROXYPROPYL) SUBSTITUTED | NIPPON SHINYAKU CO., LTD. (JP) | 1984-03-06 | — | — | US | disclosed |