Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 7/20 | 0.53 |
| ▸ | HSP90AB1 | P08238 | 7/20 | 0.53 |
| ▸ | RARB | P10826 | 2/20 | 0.51 |
| ▸ | RARG | P13631 | 2/20 | 0.51 |
| ▸ | RARA | P10276 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | XBP1 | P17861 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | APEX1 | P27695 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.41 |
| ▸ | ESRRA | P11474 | 1/20 | 0.40 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL384263 | 0.81 | RARB (0.71) | HSP90AA1HSP90AB1RARBRARGRARA | |
| SCHEMBL29654169 | 0.81 | RARB (0.71) | HSP90AA1HSP90AB1RARBRARGRARA | |
| SCHEMBL6849017 | 0.76 | GAA (0.48) | HSP90AA1HSP90AB1RARBRARGRARA | |
| SCHEMBL6850402 | 0.76 | GAA (0.48) | HSP90AA1HSP90AB1RARBRARGRARA | |
| SCHEMBL7824649 | 0.75 | THRA (0.46) | RARBRARGRARAALDH1A1TP53 | |
| SCHEMBL3810032 | 0.75 | HSP90AA1 (0.49) | HSP90AA1HSP90AB1RARBRARGRARA | |
| SCHEMBL3805383 | 0.72 | RARB (0.51) | HSP90AA1HSP90AB1RARBRARGRARA | |
| SCHEMBL11404522 | 0.72 | ESR1 (0.59) | HSP90AA1HSP90AB1MAPTALDH1A1LMNA | |
| SCHEMBL18016984 | 0.72 | ESR1 (0.59) | HSP90AA1HSP90AB1MAPTALDH1A1LMNA | |
| SCHEMBL19182177 | 0.72 | ESR1 (0.59) | HSP90AA1HSP90AB1MAPTALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1091958-A1 | SALTS OF PAROXETINE | SMITHKLINE BEECHAM PLC (GB) | 2001-04-18 | — | — | EP | disclosed |
| WO-2000001692-A1 | SALTS OF PAROXETINE | SMITHKLINE BEECHAM PLC (GB) | 2000-01-13 | — | — | WO | disclosed |