Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 10/20 | 0.39 |
| ▸ | POLL | Q9UGP5 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KLK7 | P49862 | 1/20 | 0.33 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL659767 | 0.77 | ALDH1A1 (0.40) | ALDH1A1KDM4EHPGDHSD17B10TSHR | |
| SCHEMBL660204 | 0.71 | MAOA (0.46) | ALDH1A1KDM4EHPGDHSD17B10TSHR | |
| SCHEMBL657303 | 0.68 | KDM4E (0.34) | ALDH1A1KDM4EHPGDHSD17B10TSHR | |
| SCHEMBL31606962 | 0.67 | IMPDH1 (0.36) | KDM4EPTGS2 | |
| SCHEMBL12143217 | 0.66 | TDP1 (0.46) | ALDH1A1KDM4EHPGDHSD17B10PTGS2 | |
| SCHEMBL23421679 | 0.66 | PTGS2 (0.45) | TSHRMAOAPTGS2MAOB | |
| SCHEMBL11857451 | 0.65 | CYP3A4 (0.42) | HPGDTSHRPTGS2MAPT | |
| SCHEMBL656553 | 0.64 | KDM4E (0.33) | ALDH1A1KDM4EHPGDMAOA | |
| SCHEMBL659652 | 0.64 | MAOA (0.31) | MAOA | |
| SCHEMBL9197687 | 0.64 | PTGS2 (0.40) | ALDH1A1KDM4EHPGDHSD17B10MAOA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0846109-A1 | QUINONE COMPOUND, ITS PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 1998-06-10 | — | — | EP | disclosed |