Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 3/20 | 0.45 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.44 |
| ▸ | OXER1 | Q8TDS5 | 8/20 | 0.42 |
| ▸ | DAO | P14920 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | CCR2 | P41597 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16835425 | 0.80 | OXER1 (0.46) | OXER1DAOMCL1CCR2L3MBTL1 | |
| SCHEMBL4760328 | 0.79 | NR1H2 (0.68) | NR1H2NR1H3 | |
| SCHEMBL7459847 | 0.79 | OXER1 (0.48) | OXER1DAOMCL1CCR2L3MBTL1 | |
| SCHEMBL7551690 | 0.76 | OXER1 (0.59) | OXER1DAOMCL1CCR2 | |
| SCHEMBL4467286 | 0.74 | DAO (0.47) | NR1H2NR1H3OXER1DAOMCL1 | |
| SCHEMBL4592266 | 0.74 | IDH1 (0.43) | NR1H2OXER1DAOMCL1 | |
| SCHEMBL16150477 | 0.71 | CYP1A2 (0.49) | OXER1MCL1L3MBTL1 | |
| SCHEMBL1465160 | 0.71 | NOD2 (0.47) | OXER1L3MBTL1ALDH1A1 | |
| SCHEMBL3638561 | 0.69 | DAO (0.65) | DAOMCL1CCR2ALDH1A1TSHR | |
| SCHEMBL3843739 | 0.69 | DAO (0.46) | OXER1DAOMCL1CCR2L3MBTL1 |
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-1963331-A1 | AZEPINOINDOLE DERIVATIVES AS PHARMACEUTICAL AGENTS | Exelixis, Inc. (US) | 2008-09-03 | — | — | EP | disclosed |
| WO-2007070796-A1 | AZEPINOINDOLE DERIVATIVES AS PHARMACEUTICAL AGENTS | EXELIXIS, INC. (US) | 2007-06-21 | — | — | WO | disclosed |