Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN5A | Q14524 | 3/20 | 0.40 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | TACR1 | P25103 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.37 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.36 |
| ▸ | CHRNG | P07510 | 1/20 | 0.36 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.36 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL14201144 | 0.92 | ALDH1A1 (0.39) | SCN5ASCN9AALDH1A1HPGDNPC1 | |
| SCHEMBL14229911 | 0.88 | RIPK1 (0.47) | SCN5ASCN9AALDH1A1HPGDEPHX2 | |
| SCHEMBL14201129 | 0.87 | ALDH1A1 (0.44) | ALDH1A1HPGDNPC1MAPTSLC6A2 | |
| SCHEMBL14201503 | 0.86 | MAPK1 (0.35) | ALDH1A1EPHX1SMN1; SMN2 | |
| SCHEMBL14201155 | 0.84 | ALDH1A1 (0.40) | SCN5ASCN9AALDH1A1HPGDNPC1 | |
| SCHEMBL14201172 | 0.84 | SCN5A (0.40) | SCN5ASCN9AALDH1A1HPGDEPHX2 | |
| SCHEMBL14200432 | 0.84 | EPHX2 (0.41) | SCN5ASCN9AALDH1A1HPGDEPHX2 | |
| SCHEMBL14229379 | 0.82 | ALDH1A1 (0.42) | SCN5ASCN9AALDH1A1HPGDEPHX2 | |
| SCHEMBL14229552 | 0.81 | EPHX2 (0.42) | SCN5ASCN9AALDH1A1HPGDEPHX2 | |
| SCHEMBL14201157 | 0.81 | RIPK1 (0.34) | RIPK1 |
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 3 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 |
| US-7208517-B1 | Endothelin antagonists | ABBOTT LABORTORIES (US) | 2007-04-24 | — | — | US | disclosed |