Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 2/20 | 0.46 |
| ▸ | ITGA4 | P13612 | 2/20 | 0.46 |
| ▸ | CTSS | P25774 | 5/20 | 0.45 |
| ▸ | CTSK | P43235 | 5/20 | 0.45 |
| ▸ | CTSL | P07711 | 4/20 | 0.45 |
| ▸ | CTSB | P07858 | 4/20 | 0.45 |
| ▸ | CNR1 | P21554 | 2/20 | 0.44 |
| ▸ | CNR2 | P34972 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | MMP2 | P08253 | 2/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.43 |
| ▸ | FPR1 | P21462 | 5/20 | 0.42 |
| ▸ | FPR2 | P25090 | 5/20 | 0.42 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.41 |
| ▸ | ACE | P12821 | 1/20 | 0.41 |
| ▸ | EEF2K | O00418 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7442952 | 0.92 | ITGB1 (0.53) | ITGB1ITGA4CTSSCTSKCTSL | |
| SCHEMBL7448892 | 0.90 | MMP2 (0.53) | ITGB1ITGA4CTSSCTSKCTSL | |
| SCHEMBL7444227 | 0.89 | ITGB1 (0.55) | ITGB1ITGA4CTSSCTSKCTSL | |
| SCHEMBL7453591 | 0.88 | MEN1 (0.52) | ITGB1ITGA4CA2MMP2MMP9 | |
| SCHEMBL7453817 | 0.88 | ITGB1 (0.49) | ITGB1ITGA4CTSSCTSKCTSL | |
| SCHEMBL7448284 | 0.86 | ITGB1 (0.49) | ITGB1ITGA4CTSSCTSKCTSB | |
| SCHEMBL7450515 | 0.84 | CA2 (0.50) | ITGB1ITGA4CTSSCTSKCTSL | |
| SCHEMBL7446008 | 0.82 | GPR132 (0.50) | ITGB1ITGA4CTSSCTSKCTSL | |
| SCHEMBL7450626 | 0.81 | ITGB1 (0.48) | ITGB1ITGA4CTSSCTSKCTSL | |
| SCHEMBL7381453 | 0.74 | MMP2 (0.72) | ITGB1ITGA4CTSSCTSKCTSL |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6221888-B1 | ANTIHISTAMINE, ANTIINFLAMMATORY AGENT, AUTOIMMUNE DISEASE, RHEUMATIC DISORDERS | MERCK & CO., INC. | 2001-04-24 | — | — | US | claimed |
| EP-0998282-A4 | SULFONAMIDES AS CELL ADHESION INHIBITORS | MERCK & CO INC (US) | 2000-08-30 | — | — | EP | claimed |
| EP-0998282-A1 | SULFONAMIDES AS CELL ADHESION INHIBITORS | Merck & Co., Inc. (a New Jersey corp.) (US) | 2000-05-10 | — | — | EP | claimed |
| WO-1998053818-A1 | SULFONAMIDES AS CELL ADHESION INHIBITORS | MERCK & CO., INC. (US) | 1998-12-03 | — | — | WO | claimed |