Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | CKS1B | P61024 | 1/20 | 0.50 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL8755112 | 0.89 | CA12 (0.61) | ALDH1A1TP53CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8408039 | 0.87 | PKM (0.60) | ALDH1A1TP53CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL11598778 | 0.84 | TSHR (0.53) | ALDH1A1HSD17B10KDM4EGAADAO | |
| SCHEMBL9651071 | 0.84 | MEN1 (0.59) | CYP3A4HPGDALOX15HIF1AHSD17B10 | |
| SCHEMBL8408482 | 0.83 | HPGD (0.70) | ALDH1A1TP53CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL14312211 | 0.81 | DAO (0.47) | ALDH1A1POLBL3MBTL1DAOHDAC1 | |
| SCHEMBL8409966 | 0.81 | HSP90AA1 (0.68) | ALDH1A1TP53CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8409449 | 0.81 | CA12 (0.59) | ALDH1A1TP53CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL9487127 | 0.80 | ALOX15 (0.60) | CYP3A4HPGDALOX15HIF1AHSD17B10 | |
| SCHEMBL27383637 | 0.79 | TSHR (0.51) | ALDH1A1HSD17B10KDM4EGAAMAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0778821-A1 | ORTHO-SUBSTITUTED AROMATIC ETHER COMPOUNDS AND THEIR USE IN PHARMACEUTICAL COMPOSITIONS FOR PAIN RELIEF | ZENECA LIMITED (GB) | 1997-06-18 | — | — | EP | disclosed |
| WO-1996006822-A1 | ORTHO-SUBSTITUTED AROMATIC ETHER COMPOUNDS AND THEIR USE IN PHARMACEUTICAL COMPOSITIONS FOR PAIN RELIEF | ZENECA LIMITED (GB) | 1996-03-07 | — | — | WO | disclosed |
| EP-0219302-A2 | Recording materials | FUJI PHOTO FILM CO., LTD. (JP) | 1987-04-22 | — | — | EP | disclosed |