Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 1/20 | 0.45 |
| ▸ | ITGAV | P06756 | 1/20 | 0.45 |
| ▸ | HPGDS | O60760 | 5/20 | 0.40 |
| ▸ | ABL1 | P00519 | 3/20 | 0.39 |
| ▸ | GPR132 | Q9UNW8 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CCKAR | P32238 | 2/20 | 0.34 |
| ▸ | CCKBR | P32239 | 2/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.34 |
| ▸ | BCR | P11274 | 2/20 | 0.33 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.33 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3319927 | 0.84 | ITGB1 (0.62) | ITGB1ITGAVABL1CCKARCCKBR | |
| SCHEMBL1028110 | 0.83 | ITGB1 (0.55) | ITGB1ITGAVABL1GPR132CCKAR | |
| SCHEMBL4625016 | 0.80 | ITGB1 (0.72) | ITGB1ITGAVHPGDSCA1CA2 | |
| SCHEMBL3313211 | 0.79 | ITGB1 (0.51) | ITGB1ITGAVABL1CCKARCCKBR | |
| SCHEMBL3314603 | 0.78 | ITGB1 (0.45) | ITGB1ITGAVABL1CCKARCCKBR | |
| SCHEMBL1030227 | 0.78 | ITGB1 (0.46) | ITGB1ITGAVABL1CCKARCCKBR | |
| SCHEMBL6151284 | 0.77 | ITGB1 (0.47) | ITGB1ITGAVABL1CCKARCCKBR | |
| SCHEMBL4625157 | 0.76 | ITGB1 (0.59) | ITGB1ITGAVHPGDSABL1EPHX2 | |
| SCHEMBL4624866 | 0.76 | ITGB1 (0.52) | ITGB1ITGAVCCKARCCKBR | |
| SCHEMBL4750012 | 0.76 | ITGB1 (0.49) | ITGB1ITGAVABL1 |
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-1501801-B1 | 2,6-QUINOLINYL AND 2,6-NAPHTHYL DERIVATIVES AND THEIR USE IN THE TREATMENT OF VLA-4 DEPENDENT DISEASES | UCB PHARMA SA (BE) | 2008-01-23 | — | — | EP | disclosed |