Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | APEX1 | P27695 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | ESR1 | P03372 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.49 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | KIF11 | P52732 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2721820 | 0.82 | ALDH1A1 (0.51) | NPC1RAB9APDE4BALDH1A1HSD17B10 | |
| SCHEMBL28271027 | 0.81 | NPC1 (0.49) | NPC1RAB9APDE4BALDH1A1HSD17B10 | |
| SCHEMBL19976633 | 0.81 | ALDH1A1 (0.79) | NPC1RAB9APDE4BALDH1A1HSD17B10 | |
| SCHEMBL19318218 | 0.81 | ALDH1A1 (0.59) | NPC1RAB9APDE4BALDH1A1HSD17B10 | |
| SCHEMBL6998994 | 0.80 | ALDH1A1 (0.53) | NPC1RAB9AALDH1A1HSD17B10ESR1 | |
| SCHEMBL8189292 | 0.80 | NPC1 (0.48) | NPC1RAB9APDE4BALDH1A1HSD17B10 | |
| SCHEMBL7241440 | 0.80 | NPC1 (0.48) | NPC1RAB9APDE4BALDH1A1HSD17B10 | |
| SCHEMBL1682512 | 0.80 | HIF1A (0.53) | ALDH1A1HSD17B10HTTMAPK1ESR1 | |
| SCHEMBL6450447 | 0.79 | PTGDR2 (0.50) | NPC1RAB9APDE4BALDH1A1HTT | |
| SCHEMBL29570883 | 0.79 | MIF (0.52) | NPC1RAB9AALDH1A1HSD17B10NPSR1 |
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 |