Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
| ▸ | F10 | P00742 | 6/20 | 0.35 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.34 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.34 |
| ▸ | ITGAL | P20701 | 1/20 | 0.34 |
| ▸ | ROS1 | P08922 | 1/20 | 0.34 |
| ▸ | F2 | P00734 | 1/20 | 0.34 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.33 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.33 |
| ▸ | SOS1 | Q07889 | 2/20 | 0.32 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.31 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4723190 | 1.00 | P2RX7 (0.35) | P2RX7F10ITGB2ICAM1ITGAL | |
| SCHEMBL4719076 | 1.00 | P2RX7 (0.35) | P2RX7F10ITGB2ICAM1ITGAL | |
| SCHEMBL4721173 | 0.96 | F10 (0.36) | P2RX7F10ITGB2ICAM1ITGAL | |
| SCHEMBL4766703 | 0.96 | F10 (0.36) | P2RX7F10ITGB2ICAM1ITGAL | |
| SCHEMBL4721178 | 0.96 | F10 (0.36) | P2RX7F10ITGB2ICAM1ITGAL | |
| SCHEMBL4723707 | 0.93 | P2RX7 (0.38) | P2RX7ITGB2ICAM1ITGALPDE3B | |
| SCHEMBL4723711 | 0.93 | P2RX7 (0.38) | P2RX7ITGB2ICAM1ITGALPDE3B | |
| SCHEMBL4723039 | 0.91 | P2RX7 (0.36) | P2RX7F10ITGB2ICAM1ITGAL | |
| SCHEMBL4721388 | 0.91 | P2RX7 (0.37) | P2RX7F10ITGB2ICAM1ITGAL | |
| SCHEMBL4721390 | 0.91 | P2RX7 (0.37) | P2RX7F10ITGB2ICAM1ITGAL |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1953147-A1 | HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF | Japan Tobacco, Inc. (JP) | 2008-08-06 | — | — | EP | disclosed |