Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | P2RY12 | Q9H244 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL688779 | 0.90 | NR1H4 (0.45) | NR1H4MAPTGAAMAPK10AURKA | |
| SCHEMBL274417 | 0.88 | NR1H4 (0.62) | NR1H4MAPTGAAMAPK10AURKA | |
| SCHEMBL687797 | 0.86 | NR1H4 (0.46) | NR1H4MAPTGAAMAPK10AURKA | |
| SCHEMBL275335 | 0.77 | NR1H4 (0.60) | NR1H4MAPTGAAMAPK10AURKA | |
| SCHEMBL715227 | 0.76 | CDC7 (0.43) | NR1H4MAPTGAAMAPK10AURKA | |
| SCHEMBL687825 | 0.74 | NR1H4 (0.53) | NR1H4MAPTKMT2AALDH1A1MEN1 | |
| SCHEMBL687997 | 0.74 | NR1H4 (0.53) | NR1H4MAPTKMT2AALDH1A1L3MBTL1 | |
| SCHEMBL273588 | 0.73 | NR1H4 (0.62) | NR1H4MAPK10AURKARIPK1NPC1 | |
| SCHEMBL273453 | 0.69 | NR1H4 (0.82) | NR1H4MAPTGAAMAPK10AURKA | |
| SCHEMBL275788 | 0.69 | NR1H4 (0.59) | NR1H4MAPTGAAMAPK10AURKA |
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-1532153-B1 | AZEPINOINDOLE AND PYRIDOINDOLE DERIVATIVES AS PHARMACEUTICAL AGENTS | X CEPTOR THERAPEUTICS INC (US) | 2012-02-29 | — | — | EP | claimed |