Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 2/20 | 0.41 |
| ▸ | NAAA | Q02083 | 2/20 | 0.37 |
| ▸ | MLYCD | O95822 | 1/20 | 0.37 |
| ▸ | MGLL | Q99685 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 6/20 | 0.36 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.35 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8041445 | 1.00 | EPHX2 (0.41) | EPHX2NAAAMLYCDMGLLHDAC1 | |
| SCHEMBL8037533 | 0.90 | EPHX2 (0.40) | EPHX2NAAAMLYCDEPHX1ASAH1 | |
| SCHEMBL8038463 | 0.88 | EPHX2 (0.39) | EPHX2MGLLTRPV1 | |
| SCHEMBL8036201 | 0.88 | EPHX2 (0.39) | EPHX2MGLLTRPV1 | |
| SCHEMBL8034312 | 0.87 | TBXA2R (0.38) | EPHX2MGLLTRPV1 | |
| SCHEMBL8041408 | 0.85 | SMN1; SMN2 (0.32) | — | |
| SCHEMBL8035784 | 0.83 | EPHX1 (0.40) | EPHX2NAAAMGLLHDAC1EPHX1 | |
| SCHEMBL8037862 | 0.80 | CYP3A4 (0.38) | — | |
| SCHEMBL8025618 | 0.80 | COMT (0.40) | MGLLHDAC1EPHX1 | |
| SCHEMBL8038899 | 0.78 | PPIA (0.52) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009081892-A1 | NOVEL CATECHOL DERIVATIVE, PHARMACEUTICAL COMPOSITION CONTAINING THE SAME, AND USE OF THOSE | KISSEI PHARMACEUTICAL CO., LTD. (JP) | 2009-07-02 | — | — | WO | disclosed |