Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.31 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.31 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7183400 | 1.00 | KDM4E (0.31) | KDM4EALDH1A1TDP1EPHX2CHRNB4 | |
| SCHEMBL15342870 | 0.83 | ALDH1A1 (0.38) | KDM4EALDH1A1TDP1 | |
| SCHEMBL7171470 | 0.82 | RECQL (0.30) | — | |
| SCHEMBL7171473 | 0.82 | RECQL (0.30) | — | |
| SCHEMBL7171471 | 0.82 | RECQL (0.30) | — | |
| SCHEMBL7172669 | 0.82 | RECQL (0.30) | — | |
| SCHEMBL20438668 | 0.80 | RECQL (0.31) | ALDH1A1 | |
| SCHEMBL8224071 | 0.80 | EPHX2 (0.42) | ALDH1A1EPHX2 | |
| SCHEMBL3449442 | 0.80 | EPHX2 (0.42) | ALDH1A1EPHX2 | |
| SCHEMBL24221648 | 0.78 | NPSR1 (0.37) | EPHX2CHRNB4CHRNA3 |
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-1087923-B1 | NOVEL FRAGRANCE COMPOUNDS | QUEST INT (NL) | 2003-05-28 | — | — | EP | disclosed |