Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MLNR | O43193 | 20/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL377786 | 1.00 | MLNR (0.56) | MLNRCYP3A4CYP2D6KCNH2 | |
| SCHEMBL377479 | 0.88 | MLNR (0.49) | MLNRCYP3A4CYP2D6KCNH2 | |
| SCHEMBL377805 | 0.87 | MLNR (0.56) | MLNRCYP3A4CYP2D6KCNH2 | |
| SCHEMBL377711 | 0.86 | MLNR (0.74) | MLNRCYP3A4CYP2D6KCNH2 | |
| SCHEMBL1704459 | 0.86 | MLNR (0.74) | MLNRCYP3A4CYP2D6KCNH2 | |
| SCHEMBL377798 | 0.85 | KDM4E (0.49) | MLNRCYP3A4 | |
| SCHEMBL377443 | 0.85 | MLNR (0.76) | MLNRCYP3A4CYP2D6KCNH2 | |
| SCHEMBL377832 | 0.85 | MLNR (0.76) | MLNRCYP3A4CYP2D6KCNH2 | |
| SCHEMBL377476 | 0.82 | MLNR (0.64) | MLNRCYP3A4CYP2D6KCNH2 | |
| SCHEMBL377498 | 0.82 | MLNR (0.64) | MLNRCYP3A4CYP2D6KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2029538-B1 | BENZYLPIPERAZINE DERIVATIVES AS MOTILIN RECEPTOR ANTAGONISTS | GLAXO GROUP LTD (GB) | 2012-01-25 | — | — | EP | claimed |