Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 2/20 | 0.42 |
| ▸ | DPP7 | Q9UHL4 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 4/20 | 0.40 |
| ▸ | TPH1 | P17752 | 2/20 | 0.38 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.38 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.38 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.36 |
| ▸ | BAZ2A | Q9UIF9 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
| ▸ | TYR | P14679 | 4/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27488188 | 1.00 | DPP4 (0.42) | DPP4DPP7ALDH1A1BRD4TPH1 | |
| SCHEMBL5163064 | 0.80 | ITGA4 (0.39) | ALDH1A1BRD4TPH1ITGA4ITGB7 | |
| SCHEMBL6236587 | 0.79 | ITGB1 (0.41) | ALDH1A1TPH1ITGA4PTGS2 | |
| Hydrochloric Acid SCHEMBL5165900 | 0.79 | ALDH1A1 (0.41) | ALDH1A1TPH1ITGA4ITGB7PTGS2 | |
| Hydrochloric Acid SCHEMBL6236581 | 0.78 | ALDH1A1 (0.42) | ALDH1A1TPH1ITGA4PTGS2 | |
| SCHEMBL6238973 | 0.78 | ALDH1A1 (0.40) | ALDH1A1TPH1ITGA4ITGB7PTGS2 | |
| Hydrochloric Acid SCHEMBL27502521 | 0.78 | ALDH1A1 (0.42) | ALDH1A1TPH1ITGA4PTGS2 | |
| SCHEMBL27487456 | 0.78 | ALDH1A1 (0.40) | ALDH1A1TPH1ITGA4ITGB7PTGS2 | |
| Hydrochloric Acid SCHEMBL6239874 | 0.77 | ALDH1A1 (0.42) | ALDH1A1TPH1ITGA4ITGB7PTGS2 | |
| Hydrochloric Acid SCHEMBL27487816 | 0.77 | ALDH1A1 (0.42) | ALDH1A1TPH1ITGA4ITGB7PTGS2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1196682-C | 4-pyridyl-N-acyl-L-phenylalanine | HOFFMANN LA ROCHE (CH) | 2005-04-13 | — | — | CN | disclosed |
| CN-1402709-A | 4-pyridinyl-N-acyl-L-phenylalanines | HOFFMANN LA ROCHE (CH) | 2003-03-12 | — | — | CN | disclosed |