Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 15/20 | 0.52 |
| ▸ | ITGA4 | P13612 | 15/20 | 0.52 |
| ▸ | ECE1 | P42892 | 3/20 | 0.45 |
| ▸ | ITGB7 | P26010 | 3/20 | 0.43 |
| ▸ | RORC | P51449 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16478305 | 0.99 | ITGB1 (0.51) | ITGB1ITGA4ECE1ITGB7RORC | |
| SCHEMBL298671 | 0.90 | ITGB1 (0.44) | ITGB1ITGA4ECE1ITGB7RORC | |
| SCHEMBL16478312 | 0.86 | ITGB1 (0.42) | ITGB1ITGA4ECE1ITGB7 | |
| SCHEMBL16478311 | 0.86 | ITGB1 (0.42) | ITGB1ITGA4ECE1ITGB7 | |
| SCHEMBL299948 | 0.84 | ITGB1 (0.42) | ITGB1ITGA4ECE1ITGB7 | |
| SCHEMBL16478164 | 0.83 | CTSC (0.54) | ITGB1ITGA4 | |
| SCHEMBL16478181 | 0.81 | ECE1 (0.43) | ITGB1ITGA4ECE1ITGB7 | |
| SCHEMBL16478172 | 0.81 | TACR2 (0.45) | ITGB1ITGA4ECE1 | |
| SCHEMBL16478145 | 0.81 | TACR2 (0.45) | ITGB1ITGA4ECE1 | |
| SCHEMBL16478073 | 0.81 | CTSC (0.53) | ITGB1ITGA4ECE1 |
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-2011154677-A1 | SUBSTITUTED N-[1-CYANO-2-(PHENYL)ETHYL] 1-AMINOCYCLOALK-1-YLCARBOXAMIDE COMPOUNDS - 760 | ASTRAZENECA AB (SE) | 2011-12-15 | — | — | WO | disclosed |