Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.51 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.51 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | TP53 | P04637 | 3/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | JUN | P05412 | 1/20 | 0.43 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.43 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CMA1 | P23946 | 1/20 | 0.42 |
| ▸ | PPARD | Q03181 | 1/20 | 0.40 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL1233284 | 0.85 | CYP2A6 (0.63) | KEAP1NFE2L2CYP2A6TAAR1SMN1; SMN2 | |
| Acetic Acid SCHEMBL7564503 | 0.81 | CYP2A6 (0.58) | KEAP1NFE2L2CYP2A6TAAR1SMN1; SMN2 | |
| SCHEMBL6673016 | 0.76 | CYP2A6 (0.59) | KEAP1NFE2L2CYP2A6TAAR1SMN1; SMN2 | |
| SCHEMBL10339723 | 0.75 | CYP2A6 (0.53) | KEAP1NFE2L2CYP2A6TAAR1SMN1; SMN2 | |
| SCHEMBL10370773 | 0.74 | CYP2A6 (0.66) | CYP2A6TAAR1SMN1; SMN2TP53RXFP1 | |
| SCHEMBL29898330 | 0.72 | TP53 (0.75) | SMN1; SMN2TP53MAPTHTT | |
| SCHEMBL39098 | 0.72 | TP53 (0.75) | SMN1; SMN2TP53MAPTHTT | |
| SCHEMBL6979554 | 0.71 | CYP2A6 (0.61) | KEAP1NFE2L2CYP2A6TAAR1SMN1; SMN2 | |
| SCHEMBL6710511 | 0.71 | CYP2A6 (0.61) | CYP2A6TAAR1SMN1; SMN2TP53RXFP1 | |
| SCHEMBL3070140 | 0.71 | CYP2A6 (0.61) | CYP2A6TAAR1SMN1; SMN2TP53RXFP1 |
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 |