Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 4/20 | 0.45 |
| ▸ | CA12 | O43570 | 3/20 | 0.45 |
| ▸ | CA1 | P00915 | 3/20 | 0.45 |
| ▸ | CA2 | P00918 | 3/20 | 0.45 |
| ▸ | CA4 | P22748 | 3/20 | 0.45 |
| ▸ | CA7 | P43166 | 3/20 | 0.45 |
| ▸ | CA9 | Q16790 | 3/20 | 0.45 |
| ▸ | HMGB1 | P09429 | 2/20 | 0.45 |
| ▸ | NAPRT | Q6XQN6 | 2/20 | 0.45 |
| ▸ | CA6 | P23280 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10451264 | 1.00 | ALDH1A1 (0.52) | ALDH1A1ALOX15KDM4EHPGDCA12 | |
| SCHEMBL3308292 | 1.00 | ALDH1A1 (0.52) | ALDH1A1ALOX15KDM4EHPGDCA12 | |
| Hydrochloric Acid SCHEMBL6041894 | 0.98 | ALDH1A1 (0.50) | ALDH1A1ALOX15KDM4EHPGDCA12 | |
| Tetramethylammonium Ion SCHEMBL9133968 | 0.84 | ALDH1A1 (0.48) | ALDH1A1ALOX15KDM4EHPGDCA12 | |
| Tetramethylammonium Ion SCHEMBL9132602 | 0.84 | ALDH1A1 (0.48) | ALDH1A1ALOX15KDM4EHPGDCA12 | |
| SCHEMBL2573164 | 0.83 | ALDH1A1 (0.56) | ALDH1A1ALOX15KDM4EHPGDCA12 | |
| SCHEMBL30828909 | 0.83 | ALDH1A1 (0.56) | ALDH1A1ALOX15KDM4EHPGDCA12 | |
| Phthalic Acid SCHEMBL28187004 | 0.82 | ALDH1A1 (0.70) | ALDH1A1ALOX15KDM4EHPGDCA12 | |
| SCHEMBL10933717 | 0.82 | ALDH1A1 (0.45) | ALDH1A1ALOX15KDM4EHPGDCA12 | |
| SCHEMBL6228527 | 0.82 | KDM4E (0.47) | ALDH1A1KDM4EHPGDMAPTPOLB |
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 |