Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 4/20 | 0.57 |
| ▸ | S1PR3 | Q99500 | 4/20 | 0.57 |
| ▸ | S1PR5 | Q9H228 | 4/20 | 0.57 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.51 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.50 |
| ▸ | GNAI3 | P08754 | 3/20 | 0.47 |
| ▸ | GNAO1 | P09471 | 3/20 | 0.47 |
| ▸ | GNAI1 | P63096 | 3/20 | 0.47 |
| ▸ | BCHE | P06276 | 5/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6046927 | 0.92 | S1PR1 (0.51) | S1PR1S1PR3S1PR5S1PR4HRH3 | |
| SCHEMBL6114812 | 0.84 | HRH3 (0.70) | HRH3GNAI3GNAO1GNAI1BCHE | |
| SCHEMBL1261675 | 0.84 | HRH3 (0.70) | HRH3GNAI3GNAO1GNAI1BCHE | |
| SCHEMBL28154297 | 0.84 | HRH3 (0.70) | HRH3GNAI3GNAO1GNAI1BCHE | |
| SCHEMBL4907893 | 0.84 | HRH3 (0.70) | HRH3GNAI3GNAO1GNAI1BCHE | |
| SCHEMBL1261593 | 0.84 | HRH3 (0.70) | HRH3GNAI3GNAO1GNAI1BCHE | |
| SCHEMBL1262700 | 0.84 | HRH3 (0.70) | HRH3GNAI3GNAO1GNAI1BCHE | |
| SCHEMBL1261708 | 0.84 | HRH3 (0.70) | HRH3GNAI3GNAO1GNAI1BCHE | |
| SCHEMBL1187251 | 0.84 | HRH3 (0.70) | HRH3GNAI3GNAO1GNAI1BCHE | |
| SCHEMBL1564984 | 0.84 | HRH3 (0.70) | HRH3GNAI3GNAO1GNAI1BCHE |
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-1730157-A1 | IONIC LIQUIDS COMPRISING FLUORALKYLTRIFFLUOROBORATE ANIONS | MERCK PATENT GmbH (DE) | 2006-12-13 | — | — | EP | disclosed |
| WO-2005105815-A1 | IONIC LIQUIDS COMPRISING FLUORALKYLTRIFFLUOROBORATE ANIONS | MERCK PATENT GMBH (DE) | 2005-11-10 | — | — | WO | disclosed |