Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGAV | P06756 | 17/20 | 0.39 |
| ▸ | ITGB6 | P18564 | 9/20 | 0.39 |
| ▸ | ITGB3 | P05106 | 8/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ALB | P02768 | 2/20 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7594982 | 0.81 | ITGAV (0.53) | ITGAVITGB6ITGB3 | |
| SCHEMBL7590655 | 0.70 | ITGAV (0.45) | ITGAVITGB6ITGB3 | |
| SCHEMBL7552889 | 0.70 | ITGAV (0.45) | ITGAVITGB6ITGB3 | |
| SCHEMBL7597028 | 0.68 | ITGAV (0.59) | ITGAVITGB6ITGB3 | |
| Trifluoroacetic Acid SCHEMBL7563140 | 0.68 | ITGAV (0.37) | ITGAVITGB6ITGB3 | |
| SCHEMBL6422124 | 0.66 | ITGAV (0.79) | ITGAVITGB6ITGB3 | |
| SCHEMBL6422120 | 0.66 | ITGAV (0.79) | ITGAVITGB6ITGB3 | |
| SCHEMBL16745724 | 0.62 | GNPAT (0.62) | SMN1; SMN2ALB | |
| SCHEMBL10419540 | 0.62 | ALB (0.57) | ITGB3ALB | |
| SCHEMBL21801849 | 0.62 | NOD1 (0.60) | SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1040098-A1 | INTEGRIN RECEPTOR ANTAGONISTS | Merck & Co., Inc. (a New Jersey corp.) (US) | 2000-10-04 | — | — | EP | disclosed |
| WO-1999031061-A1 | INTEGRIN RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 1999-06-24 | — | — | WO | disclosed |