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 | |
|---|---|---|---|---|
| SCHEMBL5261609 | 0.85 | ITGB1 (0.54) | ITGB1ITGA4 | |
| Hydrochloric Acid SCHEMBL5149601 | 0.84 | ITGB1 (0.53) | ITGB1ITGA4 | |
| Hydrochloric Acid SCHEMBL5377713 | 0.84 | ITGB1 (0.53) | ITGB1ITGA4 | |
| SCHEMBL5149434 | 0.80 | ITGB1 (0.44) | ITGB1ITGA4 | |
| SCHEMBL3830537 | 0.78 | ITGB1 (0.43) | ITGB1ITGA4 | |
| SCHEMBL3834959 | 0.77 | ITGB1 (0.42) | ITGB1ITGA4 | |
| SCHEMBL3833642 | 0.77 | ITGB1 (0.42) | ITGB1ITGA4 | |
| Hydrochloric Acid SCHEMBL3833611 | 0.76 | ITGB1 (0.42) | ITGB1ITGA4 | |
| SCHEMBL2979007 | 0.75 | ITGB1 (0.55) | ITGB1ITGA4 | |
| SCHEMBL3831447 | 0.75 | ITGB1 (0.41) | ITGB1ITGA4 |
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-1780201-A2 | PHENYLALANINE ENAMIDE DERIVATIVES POSSESSING A CYCLOBUTENE GROUP, FOR USE AS INTEGRIN INHIBITORS | Celltech R&D Limited (GB) | 2007-05-02 | — | — | EP | disclosed |