Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 2/20 | 0.64 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.64 |
| ▸ | TSHR | P16473 | 1/20 | 0.64 |
| ▸ | PSEN1 | P49768 | 8/20 | 0.50 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | F7 | P08709 | 2/20 | 0.43 |
| ▸ | F3 | P13726 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.43 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.43 |
| ▸ | OXER1 | Q8TDS5 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
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 | 1.00 | PTGS1 (0.64) | PTGS1PTGS2CYP3A4CYP1A2TSHR | |
| SCHEMBL7823401 | 0.83 | PSEN1 (0.57) | PTGS1PTGS2CYP3A4CYP1A2TSHR | |
| Trolox SCHEMBL1651402 | 0.80 | PTGS1 (1.00) | PTGS1PTGS2CYP3A4CYP1A2TSHR | |
| Trolox SCHEMBL3226 | 0.80 | PTGS1 (1.00) | PTGS1PTGS2CYP3A4CYP1A2TSHR | |
| Trolox SCHEMBL1927837 | 0.80 | PTGS1 (1.00) | PTGS1PTGS2CYP3A4CYP1A2TSHR | |
| Trolox SCHEMBL17713594 | 0.78 | PTGS1 (0.89) | PTGS1PTGS2CYP3A4CYP1A2TSHR | |
| Trolox SCHEMBL15415513 | 0.77 | PTGS1 (0.78) | PTGS1PTGS2CYP3A4CYP1A2TSHR | |
| Trolox SCHEMBL7895023 | 0.77 | PTGS1 (0.91) | PTGS1PTGS2CYP3A4CYP1A2TSHR | |
| Edetic Acid SCHEMBL623727 | 0.74 | PTGS1 (0.76) | PTGS1PTGS2CYP3A4CYP1A2TSHR | |
| Trolox SCHEMBL8652487 | 0.74 | PTGS1 (0.76) | PTGS1PTGS2CYP3A4CYP1A2TSHR |
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 |