Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.31 |
| ▸ | NCOR2 | Q9Y618 | 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 | |
|---|---|---|---|---|
| SCHEMBL6236149 | 1.00 | CYP1A2 (0.36) | CYP1A2CA1CA9HDAC3HDAC4 | |
| SCHEMBL6236751 | 1.00 | CYP1A2 (0.36) | CYP1A2CA1CA9HDAC3HDAC4 | |
| SCHEMBL6235544 | 0.90 | CYP1A2 (0.41) | CYP1A2CA1CA9HDAC3HDAC4 | |
| SCHEMBL6235549 | 0.90 | CYP1A2 (0.41) | CYP1A2CA1CA9HDAC3HDAC4 | |
| SCHEMBL30886695 | 0.90 | CYP1A2 (0.41) | CYP1A2CA1CA9HDAC3HDAC4 | |
| SCHEMBL15067829 | 0.88 | CYP1A2 (0.45) | CYP1A2 | |
| SCHEMBL17845981 | 0.83 | CYP1A2 (0.44) | CYP1A2 | |
| SCHEMBL6233013 | 0.80 | CYP1A2 (0.46) | CYP1A2CA1CA9HDAC3HDAC4 | |
| SCHEMBL6233018 | 0.80 | CYP1A2 (0.46) | CYP1A2CA1CA9HDAC3HDAC4 | |
| SCHEMBL2597366 | 0.78 | CYP1A2 (0.51) | CYP1A2HDAC3HDAC4HDAC1HDAC7 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1167362-B1 | Fragance precursors | GIVAUDAN SA (CH) | 2005-05-25 | — | — | EP | disclosed |
| EP-1167362-A1 | Fragance precursors | Givaudan SA (CH) | 2002-01-02 | — | — | EP | disclosed |