Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA4 | P13612 | 16/20 | 0.66 |
| ▸ | ITGB1 | P05556 | 14/20 | 0.66 |
| ▸ | ITGB7 | P26010 | 6/20 | 0.66 |
| ▸ | ITGAV | P06756 | 2/20 | 0.55 |
| ▸ | ITGA5 | P08648 | 3/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL6368398 | 0.96 | ITGA4 (0.69) | ITGA4ITGB1ITGB7ITGAVITGA5 | |
| SCHEMBL5687080 | 0.93 | ITGA4 (0.66) | ITGA4ITGB1ITGB7ITGAVITGA5 | |
| SCHEMBL6372387 | 0.93 | ITGA4 (0.66) | ITGA4ITGB1ITGB7ITGAVITGA5 | |
| SCHEMBL6367900 | 0.91 | ITGA4 (0.63) | ITGA4ITGB1ITGB7ITGAVITGA5 | |
| SCHEMBL6372412 | 0.89 | ITGA4 (0.72) | ITGA4ITGB1ITGB7ITGAVITGA5 | |
| SCHEMBL6368166 | 0.88 | ITGB1 (0.72) | ITGA4ITGB1ITGB7ITGAVITGA5 | |
| SCHEMBL6368456 | 0.87 | ITGA4 (0.70) | ITGA4ITGB1ITGB7ITGAVITGA5 | |
| SCHEMBL6368512 | 0.87 | ITGA4 (0.72) | ITGA4ITGB1ITGB7ITGA5 | |
| SCHEMBL6367880 | 0.87 | ITGA4 (0.69) | ITGA4ITGB1ITGB7ITGAVITGA5 | |
| SCHEMBL6368438 | 0.87 | ITGA4 (0.69) | ITGA4ITGB1ITGB7ITGAVITGA5 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6903075-B1 | Heterocyclic amide compounds as cell adhesion inhibitors | MERCK & CO., INC. (US) | 2005-06-07 | — | — | US | claimed |
| EP-1001764-A4 | HETEROCYCLIC AMIDE COMPOUNDS AS CELL ADHESION INHIBITORS | MERCK & CO INC (US) | 2005-08-24 | — | — | EP | disclosed |
| US-6903075-B1 | Heterocyclic amide compounds as cell adhesion inhibitors | MERCK & CO., INC. (US) | 2005-06-07 | — | — | US | disclosed |
| EP-1001764-A1 | HETEROCYCLIC AMIDE COMPOUNDS AS CELL ADHESION INHIBITORS | Merck & Co., Inc. (a New Jersey corp.) (US) | 2000-05-24 | — | — | EP | disclosed |
| WO-1999064395-A1 | HETEROCYCLIC AMIDE COMPOUNDS AS CELL ADHESION INHIBITORS | MERCK & CO., INC. (US) | 1999-12-16 | — | — | WO | disclosed |
| WO-1998053814-A1 | HETEROCYCLIC AMIDE COMPOUNDS AS CELL ADHESION INHIBITORS | MERCK & CO., INC. (US) | 1998-12-03 | — | — | WO | disclosed |