Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.41 |
| ▸ | CYP3A5 | P20815 | 2/20 | 0.41 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.41 |
| ▸ | KCNA5 | P22460 | 5/20 | 0.39 |
| ▸ | TBXAS1 | P24557 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4688473 | 0.86 | POLB (0.40) | CNR1 | |
| SCHEMBL4689076 | 0.80 | LMNA (0.47) | CNR1ALDH1A1FFAR2KCNA5 | |
| SCHEMBL5065117 | 0.77 | SMN1; SMN2 (0.44) | KCNA5TBXAS1 | |
| SCHEMBL4540654 | 0.75 | KCNA5 (0.64) | KCNA5 | |
| SCHEMBL3522581 | 0.75 | CNR1 (0.55) | CNR1ALDH1A1TBXAS1 | |
| SCHEMBL5317668 | 0.74 | CYP19A1 (0.55) | CNR1CYP19A1ALDH1A1CYP3A4CYP3A5 | |
| SCHEMBL5264331 | 0.73 | LMNA (0.52) | CNR1KCNA5 | |
| SCHEMBL16115271 | 0.73 | SLC6A2 (0.60) | CYP3A4 | |
| SCHEMBL2653184 | 0.72 | CNR1 (0.56) | CNR1ALDH1A1CYP3A4 | |
| SCHEMBL15812308 | 0.71 | AOC3 (0.53) | CYP3A4FFAR2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1496838-A4 | SUBSTITUTED AMIDES | MERCK & CO INC (US) | 2008-07-02 | — | — | EP | claimed |
| EP-1496838-A2 | SUBSTITUTED AMIDES | Merck & Co., Inc. (US) | 2005-01-19 | — | — | EP | claimed |
| WO-2003077847-A2 | SUBSTITUTED AMIDES | MERCK & CO., INC. (US) | 2003-09-25 | — | — | WO | claimed |
| EP-1496838-A4 | SUBSTITUTED AMIDES | MERCK & CO INC (US) | 2008-07-02 | — | — | EP | disclosed |
| EP-1496838-A2 | SUBSTITUTED AMIDES | Merck & Co., Inc. (US) | 2005-01-19 | — | — | EP | disclosed |
| WO-2003077847-A2 | SUBSTITUTED AMIDES | MERCK & CO., INC. (US) | 2003-09-25 | — | — | WO | disclosed |