Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.39 |
| ▸ | TACR1 | P25103 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14229475 | 0.91 | ALDH1A1 (0.39) | EPHX2ALDH1A1HPGDMAPTNPC1 | |
| SCHEMBL14230192 | 0.86 | ALDH1A1 (0.45) | ALDH1A1HPGDTACR1NPC1LTB4R2 | |
| SCHEMBL14201172 | 0.86 | SCN5A (0.40) | EPHX2ALDH1A1HPGDSCN5ASCN9A | |
| SCHEMBL14229559 | 0.85 | MAPK1 (0.36) | ALDH1A1 | |
| SCHEMBL14229752 | 0.85 | ALDH1A1 (0.39) | EPHX2ALDH1A1HPGDMAPTNPC1 | |
| SCHEMBL14229379 | 0.84 | ALDH1A1 (0.42) | EPHX2ALDH1A1HPGDSCN5ASCN9A | |
| SCHEMBL14229911 | 0.81 | RIPK1 (0.47) | EPHX2ALDH1A1HPGDSCN5ASCN9A | |
| SCHEMBL14201145 | 0.81 | SCN5A (0.40) | EPHX2ALDH1A1HPGDSCN5ASCN9A | |
| SCHEMBL14200432 | 0.81 | EPHX2 (0.41) | EPHX2ALDH1A1HPGDSCN5ASCN9A | |
| SCHEMBL14229079 | 0.80 | POLB (0.33) | MAPTGAA |
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-7365093-B2 | Endothelin antagonists | ABBOTT LABORATORIES (US) | 2008-04-29 | — | — | US | disclosed |
| US-7208517-B1 | Endothelin antagonists | ABBOTT LABORTORIES (US) | 2007-04-24 | — | — | US | disclosed |