Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 4/20 | 0.53 |
| ▸ | ITGAL | P20701 | 8/20 | 0.49 |
| ▸ | ITGB2 | P05107 | 7/20 | 0.49 |
| ▸ | ICAM1 | P05362 | 7/20 | 0.49 |
| ▸ | NOS3 | P29474 | 3/20 | 0.45 |
| ▸ | NOS1 | P29475 | 3/20 | 0.45 |
| ▸ | NOS2 | P35228 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6499090 | 0.91 | CAPN1 (0.54) | CAPN1ITGALITGB2ICAM1MAPK1 | |
| SCHEMBL6499094 | 0.91 | CAPN1 (0.54) | CAPN1ITGALITGB2ICAM1MAPK1 | |
| SCHEMBL8296890 | 0.91 | ITGAL (0.50) | CAPN1ITGALITGB2ICAM1KDM4E | |
| SCHEMBL8298603 | 0.89 | ITGAL (0.49) | CAPN1ITGALITGB2ICAM1KDM4E | |
| SCHEMBL6506580 | 0.89 | ITGAL (0.49) | CAPN1ITGALITGB2ICAM1KDM4E | |
| SCHEMBL6506577 | 0.89 | ITGAL (0.49) | CAPN1ITGALITGB2ICAM1KDM4E | |
| SCHEMBL6503498 | 0.89 | ITGAL (0.49) | CAPN1ITGALITGB2ICAM1KDM4E | |
| SCHEMBL6503495 | 0.89 | ITGAL (0.49) | CAPN1ITGALITGB2ICAM1KDM4E | |
| SCHEMBL8297244 | 0.89 | ITGAL (0.49) | CAPN1ITGALITGB2ICAM1KDM4E | |
| SCHEMBL6533299 | 0.89 | ITGAL (0.53) | CAPN1ITGALITGB2ICAM1POLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005016883-A2 | ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF | ICOS CORPORATION (US) | 2005-02-24 | — | — | WO | disclosed |