Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | CNR1 | P21554 | 13/20 | 0.48 |
| ▸ | CNR2 | P34972 | 8/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4692132 | 0.95 | CNR1 (0.52) | ALDH1A1CNR1CNR2 | |
| SCHEMBL2653467 | 0.85 | CNR1 (0.62) | ALDH1A1CNR1CNR2USP2POLB | |
| SCHEMBL4691613 | 0.85 | CNR1 (0.62) | ALDH1A1CNR1CNR2USP2POLB | |
| SCHEMBL4688668 | 0.85 | CNR1 (0.61) | ALDH1A1CNR1CNR2USP2POLB | |
| SCHEMBL4690861 | 0.84 | CNR1 (0.63) | ALDH1A1CNR1CNR2USP2POLB | |
| SCHEMBL4688836 | 0.84 | CNR1 (0.60) | CNR1CNR2 | |
| SCHEMBL4695337 | 0.84 | CNR1 (0.58) | CNR1CNR2CYP2D6CYP2C9 | |
| SCHEMBL4688723 | 0.84 | CNR1 (0.62) | ALDH1A1CNR1CNR2 | |
| SCHEMBL4693315 | 0.83 | CYP1A2 (0.56) | ALDH1A1CNR1CNR2USP2POLB | |
| SCHEMBL2652057 | 0.83 | CNR1 (0.62) | CNR1CNR2 |
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 |