Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB2 | P05107 | 1/20 | 0.35 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.35 |
| ▸ | ITGAL | P20701 | 1/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.34 |
| ▸ | F10 | P00742 | 2/20 | 0.34 |
| ▸ | F2 | P00734 | 1/20 | 0.34 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.34 |
| ▸ | SMPD3 | Q9NY59 | 3/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | MYC | P01106 | 2/20 | 0.32 |
| ▸ | WDR5 | P61964 | 2/20 | 0.32 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.32 |
| ▸ | KCNK3 | O14649 | 2/20 | 0.32 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4724276 | 1.00 | ITGB2 (0.35) | ITGB2ICAM1ITGALMCHR1F10 | |
| SCHEMBL4718912 | 0.91 | P2RX7 (0.36) | F10P2RX7MYCWDR5PDE3B | |
| SCHEMBL4718914 | 0.91 | P2RX7 (0.36) | F10P2RX7MYCWDR5PDE3B | |
| SCHEMBL4724182 | 0.91 | P2RX7 (0.36) | F10P2RX7MYCWDR5PDE3B | |
| SCHEMBL4720845 | 0.90 | PDE4A (0.36) | ITGB2ICAM1ITGALPDE4APDE4B | |
| SCHEMBL4721691 | 0.90 | F10 (0.38) | ITGB2ICAM1ITGALF10F2 | |
| SCHEMBL4724293 | 0.90 | F10 (0.38) | ITGB2ICAM1ITGALF10F2 | |
| SCHEMBL4721689 | 0.90 | F10 (0.38) | ITGB2ICAM1ITGALF10F2 | |
| SCHEMBL4722273 | 0.90 | SMPD3 (0.45) | ITGB2ICAM1ITGALSMPD3 | |
| SCHEMBL4722270 | 0.90 | SMPD3 (0.45) | ITGB2ICAM1ITGALSMPD3 |
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 |