Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL13698637 | 1.00 | ITGA4 (0.51) | ITGA4ITGB1 | |
| SCHEMBL92548 | 0.95 | ITGA4 (0.49) | ITGA4ITGB1 | |
| SCHEMBL10273041 | 0.93 | ITGB1 (0.44) | ITGA4ITGB1 | |
| SCHEMBL84769 | 0.93 | ITGB1 (0.60) | ITGA4ITGB1 | |
| SCHEMBL93091 | 0.91 | ITGB1 (0.51) | ITGA4ITGB1 | |
| SCHEMBL92640 | 0.90 | ITGA4 (0.52) | ITGA4ITGB1 | |
| SCHEMBL92648 | 0.90 | ITGA4 (0.55) | ITGA4ITGB1 | |
| SCHEMBL10273151 | 0.89 | ITGA4 (0.54) | ITGA4ITGB1 | |
| SCHEMBL92486 | 0.89 | ITGA4 (0.55) | ITGA4ITGB1 | |
| SCHEMBL92561 | 0.88 | ITGA4 (0.51) | ITGA4ITGB1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8129366-B2 | VLA-4 inhibitory drug | DAIICHI SANKYO COMPANY, LIMITED (JP) | 2012-03-06 | — | — | US | disclosed |