Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSEN1 | P49768 | 10/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.44 |
| ▸ | TTPA | P49638 | 2/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | PRKCA | P17252 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| Trolox SCHEMBL7823398 | 0.83 | PTGS1 (0.64) | PSEN1CYP3A4TSHRPTGS1PTGS2 | |
| Trolox SCHEMBL7823404 | 0.83 | PTGS1 (0.64) | PSEN1CYP3A4TSHRPTGS1PTGS2 | |
| SCHEMBL14948991 | 0.81 | PTPN1 (0.59) | PSEN1CYP3A4TSHRPTGS1PTGS2 | |
| SCHEMBL14948986 | 0.81 | PTPN1 (0.59) | PSEN1CYP3A4TSHRPTGS1PTGS2 | |
| SCHEMBL14948992 | 0.79 | PSEN1 (0.56) | PSEN1CYP3A4TSHRPTGS1PTGS2 | |
| SCHEMBL14948984 | 0.79 | PSEN1 (0.56) | PSEN1CYP3A4TSHRPTGS1PTGS2 | |
| SCHEMBL8539222 | 0.76 | PSEN1 (0.55) | PSEN1CYP3A4TSHRPTGS1PTGS2 | |
| SCHEMBL11701874 | 0.75 | PTGS1 (0.66) | PSEN1CYP3A4TSHRPTGS1PTGS2 | |
| SCHEMBL2059457 | 0.75 | PTGS1 (0.66) | PSEN1CYP3A4TSHRPTGS1PTGS2 | |
| SCHEMBL11705224 | 0.75 | PTGS1 (0.66) | PSEN1CYP3A4TSHRPTGS1PTGS2 |
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 |