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 | |
|---|---|---|---|---|
| SCHEMBL5146276 | 1.00 | ITGB1 (0.48) | ITGB1ITGA4 | |
| SCHEMBL5149434 | 0.88 | ITGB1 (0.44) | ITGB1ITGA4 | |
| SCHEMBL30192895 | 0.80 | PPARG (0.50) | — | |
| SCHEMBL29231873 | 0.80 | PPARG (0.50) | — | |
| SCHEMBL2880989 | 0.79 | ITGB1 (0.74) | ITGB1ITGA4 | |
| SCHEMBL5261609 | 0.78 | ITGB1 (0.54) | ITGB1ITGA4 | |
| Hydrochloric Acid SCHEMBL5377713 | 0.77 | ITGB1 (0.53) | ITGB1ITGA4 | |
| Hydrochloric Acid SCHEMBL5149601 | 0.77 | ITGB1 (0.53) | ITGB1ITGA4 | |
| SCHEMBL1022281 | 0.77 | LMNA (0.46) | — | |
| SCHEMBL4684731 | 0.76 | CTSK (0.51) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7291645-B2 | Phenylalanine derivatives as alpha 4 integrin inhibitors | ELAN PHARMACEUTICALS, INC. (US) | 2007-11-06 | — | — | US | disclosed |
| US-7015216-B2 | Heteroaryl-β-alanine derivatives as alpha 4 integrin inhibitors | ELAN PHARMACEUTICALS, INC. (US) | 2006-03-21 | — | — | US | disclosed |
| US-6689781-B2 | TREATING AN INFLAMMATORY CONDITION IN A MAMMALIAN PATIENT WHICH CONDITION IS MEDIATED BY VLA-4 | ELAN PHARMACEUTICALS, INC. | 2004-02-10 | — | — | US | disclosed |