Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDPS | P14324 | 7/20 | 0.43 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.37 |
| ▸ | SMPD1 | P17405 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | GGPS1 | O95749 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL28190435 | 0.79 | FDPS (0.45) | FDPSSCN5ASCN9ASMPD1ALDH1A1 | |
| SCHEMBL28361463 | 0.79 | FDPS (0.45) | FDPSSCN5ASCN9ASMPD1ALDH1A1 | |
| SCHEMBL9282122 | 0.76 | FDPS (0.41) | FDPSSCN5ASCN9AGGPS1CA1 | |
| SCHEMBL10535324 | 0.76 | FDPS (0.41) | FDPSSCN5ASCN9AGGPS1CA1 | |
| SCHEMBL16755474 | 0.74 | CES2 (0.47) | FDPSSMPD1GGPS1 | |
| SCHEMBL8529183 | 0.74 | FDPS (0.40) | FDPSGGPS1CA1CA2 | |
| SCHEMBL29416272 | 0.74 | FDPS (0.40) | FDPSGGPS1CA1CA2 | |
| SCHEMBL1327457 | 0.73 | FDPS (0.43) | FDPSSMPD1ALDH1A1TP53CA1 | |
| SCHEMBL11354721 | 0.73 | FDPS (0.43) | FDPSSCN5ASCN9ASMPD1TP53 | |
| SCHEMBL9656410 | 0.73 | FDPS (0.43) | FDPSSMPD1TP53CA1CA2 |
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-0885215-A1 | NOVEL BENZO-1,3-DIOXOLYL- AND BENZOFURANYL SUBSTITUTED PYRROLIDINE DERIVATIVES AS ENDOTHELIN ANTAGONISTS | Abbott Laboratories (US) | 1998-12-23 | — | — | EP | disclosed |
| WO-1997030045-A1 | NOVEL BENZO-1,3-DIOXOLYL- AND BENZOFURANYL SUBSTITUTED PYRROLIDINE DERIVATIVES AS ENDOTHELIN ANTAGONISTS | ABBOTT LABORATORIES (US) | 1997-08-21 | — | — | WO | disclosed |