Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 20/20 | 0.56 |
| ▸ | ITGAV | P06756 | 20/20 | 0.56 |
| ▸ | ITGA2B | P08514 | 3/20 | 0.46 |
| ▸ | ITGB5 | P18084 | 3/20 | 0.44 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7910542 | 0.92 | ITGAV (0.60) | ITGB3ITGAVITGA2BITGB5ITGB1 | |
| SCHEMBL7909519 | 0.84 | ITGB3 (0.53) | ITGB3ITGAVITGA2BITGB5 | |
| SCHEMBL8621139 | 0.80 | ITGB3 (0.37) | ITGB3ITGAVITGA2B | |
| Hydrochloric Acid SCHEMBL8619234 | 0.80 | ITGB3 (0.36) | ITGB3ITGAVITGA2B | |
| SCHEMBL7458235 | 0.78 | ITGB3 (0.57) | ITGB3ITGAVITGA2B | |
| SCHEMBL7380582 | 0.75 | ITGAV (0.47) | ITGB3ITGAVITGA2BITGB5 | |
| SCHEMBL7007604 | 0.75 | ITGAV (0.48) | ITGB3ITGAVITGA2BITGB5ITGB1 | |
| SCHEMBL7013233 | 0.74 | ITGB3 (0.45) | ITGB3ITGAVITGA2BITGB5ITGB1 | |
| Hydrochloric Acid SCHEMBL8621091 | 0.73 | ITGB3 (0.34) | ITGB3ITGAVITGA2B | |
| SCHEMBL7009416 | 0.72 | ITGAV (0.41) | ITGB3ITGAVITGA2BITGB5ITGB1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6211184-B1 | TETRAHYDRO-PYRAZINE OR PYRIMIDINE DERIVATIVES; VITRONECTIN RECEPTOR ANTAGONIST; OSTEOPOROSIS; ANTIINFLAMMATORY, ANTITUMOR AGENTS; ANGIOGENESIS AND RESTENOSIS INHIBITORS | MERCK & CO., INC. | 2001-04-03 | — | — | US | disclosed |
| US-5981546-A | Integrin antagonists | MERCK & CO., INC. (US) | 1999-11-09 | — | — | US | disclosed |