Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | COXFA4 | O00483 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 9/20 | 0.41 |
| ▸ | EPAS1 | Q99814 | 9/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | TLR3 | O15455 | 1/20 | 0.39 |
| ▸ | EP300 | Q09472 | 4/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | XDH | P47989 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9092543 | 0.86 | HIF1A (0.44) | COXFA4HIF1AEPAS1ALDH1A1HPGD | |
| Acetic Acid SCHEMBL9092012 | 0.85 | HIF1A (0.42) | COXFA4HIF1AEPAS1ALDH1A1HPGD | |
| SCHEMBL9092249 | 0.82 | HIF1A (0.46) | HIF1AEPAS1ALDH1A1HPGDCYP3A4 | |
| SCHEMBL9091985 | 0.80 | HIF1A (0.45) | HIF1AEPAS1ALDH1A1HPGDEP300 | |
| SCHEMBL9090422 | 0.80 | HIF1A (0.45) | HIF1AEPAS1ALDH1A1HPGDEP300 | |
| SCHEMBL27665986 | 0.78 | COXFA4 (0.57) | COXFA4HIF1AEPAS1ALDH1A1HPGD | |
| SCHEMBL9092974 | 0.75 | HIF1A (0.46) | HIF1AEPAS1ALDH1A1HPGDCYP3A4 | |
| SCHEMBL12580741 | 0.74 | ALDH1A1 (0.43) | COXFA4HIF1AEPAS1ALDH1A1HPGD | |
| SCHEMBL12095636 | 0.73 | HSD17B10 (0.45) | HSD17B10 | |
| SCHEMBL3307991 | 0.71 | PKM (0.45) | ALDH1A1KDM4ECA12CA1POLB |
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 |
|---|---|---|---|---|---|---|---|
| US-5574049-A | POTASSIUM CHANNEL OPENERS, BRONCHODILATORS, ANTIASTHMA | SANDOZ LTD. (CH) | 1996-11-12 | — | — | US | disclosed |
| EP-0623129-A1 | 2,2-DIALKYL- AND 2,2-DIALKYL-3,4-DIHYDRO-3-HYDROXY-2H-1-BENZOPYR ANS, THEIR USE AS PHARMACEUTICALS | Novartis AG (CH) | 1994-11-09 | — | — | EP | disclosed |
| WO-1994012493-A1 | 2,2-DIALKYL- AND 2,2-DIALKYL-3,4-DIHYDRO-3-HYDROXY-2H-1-BENZOPYR ANS, THEIR USE AS PHARMACEUTICALS | SANDOZ, LTD. (CH) | 1994-06-09 | — | — | WO | disclosed |