Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 8/20 | 0.47 |
| ▸ | FGF23 | Q9GZV9 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL29106073 | 0.85 | ALDH1A1 (0.44) | NFE2L2ALDH1A1HPGDALOX12L3MBTL1 | |
| SCHEMBL1722260 | 0.85 | ALDH1A1 (0.44) | NFE2L2ALDH1A1HPGDALOX12L3MBTL1 | |
| SCHEMBL1932226 | 0.85 | ALDH1A1 (0.44) | NFE2L2ALDH1A1HPGDALOX12L3MBTL1 | |
| SCHEMBL13917683 | 0.85 | NFE2L2 (0.56) | NFE2L2FGF23ALDH1A1HPGDALOX12 | |
| SCHEMBL9720760 | 0.85 | NFE2L2 (0.56) | NFE2L2FGF23ALDH1A1HPGDALOX12 | |
| SCHEMBL9720756 | 0.85 | NFE2L2 (0.56) | NFE2L2FGF23ALDH1A1HPGDALOX12 | |
| SCHEMBL31255957 | 0.79 | TSHR (0.39) | ALDH1A1L3MBTL1TSHRKDM4ECYP1A2 | |
| SCHEMBL823205 | 0.79 | NFE2L2 (0.49) | NFE2L2FGF23ALDH1A1HPGDALOX12 | |
| SCHEMBL12818757 | 0.79 | APP (0.37) | NFE2L2FGF23ALDH1A1HPGDALOX12 | |
| SCHEMBL553822 | 0.75 | NR1H3 (0.44) | NFE2L2FGF23RELANR1H3TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5274104-A | N-substituted heterocyclic derivatives useful in the treatment of cardiovascular disorders | ELF SANOFI, A FRENCH CORP. (FR) | 1993-12-28 | — | — | US | disclosed |
| EP-0519831-A1 | N-Substituted heterocyclic derivatives, their preparation, and pharmaceutical compositions containing them | SANOFI (FR) | 1992-12-23 | — | — | EP | disclosed |