Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 10/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | P2RX7 | Q99572 | 4/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.30 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.30 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4691568 | 0.93 | CNR1 (0.43) | CNR1CNR2CYP2C9 | |
| SCHEMBL4692012 | 0.91 | CNR1 (0.41) | CNR1P2RX7TRPA1CNR2EPHX2 | |
| SCHEMBL4691595 | 0.87 | CNR1 (0.39) | CNR1CNR2CYP2C9 | |
| SCHEMBL4788252 | 0.86 | CNR1 (0.49) | CNR1CNR2DGAT2CYP2C9CYP2C19 | |
| SCHEMBL4688592 | 0.85 | CNR1 (0.40) | CNR1CNR2CYP2C9 | |
| SCHEMBL3374144 | 0.83 | CNR1 (0.57) | CNR1CNR2CYP2C9 | |
| SCHEMBL4691419 | 0.82 | CNR1 (0.51) | CNR1ARCNR2CYP2C9 | |
| SCHEMBL4688115 | 0.81 | CNR1 (0.48) | CNR1CNR2CYP2C9 | |
| SCHEMBL4693237 | 0.81 | CNR1 (0.48) | CNR1CNR2CYP2C9 | |
| SCHEMBL4694454 | 0.80 | CNR1 (0.47) | CNR1CNR2DGAT2CYP2C9 |
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 |