Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA4 | P13612 | 17/20 | 0.46 |
| ▸ | ITGB1 | P05556 | 4/20 | 0.46 |
| ▸ | YAP1 | P46937 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6744662 | 1.00 | ITGA4 (0.46) | ITGA4ITGB1YAP1PPARG | |
| SCHEMBL6741692 | 0.93 | ITGA4 (0.52) | ITGA4ITGB1 | |
| SCHEMBL6741689 | 0.93 | ITGA4 (0.52) | ITGA4ITGB1 | |
| SCHEMBL6741690 | 0.87 | ITGA4 (0.43) | ITGA4ITGB1YAP1 | |
| SCHEMBL6743762 | 0.83 | ITGA4 (0.51) | ITGA4ITGB1 | |
| SCHEMBL6741696 | 0.76 | ITGA4 (0.43) | ITGA4ITGB1YAP1 | |
| SCHEMBL6742874 | 0.75 | ITGA4 (0.52) | ITGA4ITGB1 | |
| SCHEMBL6740340 | 0.74 | ITGA4 (0.41) | ITGA4ITGB1YAP1PPARG | |
| SCHEMBL7103881 | 0.72 | ITGA4 (0.53) | ITGA4ITGB1 | |
| SCHEMBL7103883 | 0.72 | ITGA4 (0.53) | 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-6685617-B1 | 4-(((-1-CARBOXY-2-(4-((2,6-DICHLOROBENZOYL)AMINE)PHENYL)ETHYL) AMINO)CARBONYL)-3-OXO-3-THIAZOLIDINEBUTANOIC ACID, USED AS ANTAGONISTS FOR CELLULAR ADHESION MOLECULES, AND ADMINISTERED AS ANTIINFLAMMATORY AGENTS | PHARMACIA & UPJOHN COMPANY | 2004-02-03 | — | — | US | disclosed |