Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 12/20 | 0.55 |
| ▸ | ITGA5 | P08648 | 4/20 | 0.55 |
| ▸ | ITGA4 | P13612 | 8/20 | 0.50 |
| ▸ | ITGB7 | P26010 | 3/20 | 0.50 |
| ▸ | ITGAV | P06756 | 4/20 | 0.44 |
| ▸ | ITGA2 | P17301 | 1/20 | 0.44 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.42 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6367392 | 0.92 | ITGB1 (0.46) | ITGB1ITGA5ITGA4ITGB7ITGAV | |
| SCHEMBL6367319 | 0.90 | ITGB1 (0.53) | ITGB1ITGA5ITGA4ITGB7ITGAV | |
| SCHEMBL6429378 | 0.89 | ITGB1 (0.67) | ITGB1ITGA5ITGA4ITGB7ITGAV | |
| SCHEMBL6373924 | 0.87 | ITGB1 (0.59) | ITGB1ITGA5ITGA4ITGB7ITGAV | |
| SCHEMBL6367276 | 0.86 | ITGB1 (0.48) | ITGB1ITGA5ITGA4ITGB7ITGAV | |
| SCHEMBL6368426 | 0.83 | ITGB1 (0.58) | ITGB1ITGA5ITGA4ITGB7HCRTR1 | |
| SCHEMBL6431309 | 0.83 | ITGB1 (0.58) | ITGB1ITGA5ITGA4ITGB7ITGAV | |
| SCHEMBL6368039 | 0.83 | ITGB1 (0.66) | ITGB1ITGA5ITGA4ITGB7ITGAV | |
| SCHEMBL6369020 | 0.83 | ITGB1 (0.57) | ITGB1ITGA5ITGA4ITGB7ITGAV | |
| SCHEMBL6429533 | 0.82 | ITGB1 (0.52) | ITGB1ITGA5ITGA4ITGB7ITGAV |
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 |
|---|---|---|---|---|---|---|---|
| EP-1001764-A4 | HETEROCYCLIC AMIDE COMPOUNDS AS CELL ADHESION INHIBITORS | MERCK & CO INC (US) | 2005-08-24 | — | — | EP | claimed |
| US-6903075-B1 | Heterocyclic amide compounds as cell adhesion inhibitors | MERCK & CO., INC. (US) | 2005-06-07 | — | — | US | claimed |
| JP-2002512625-A | — | — | 2002-04-23 | — | — | JP | claimed |
| EP-1001764-A1 | HETEROCYCLIC AMIDE COMPOUNDS AS CELL ADHESION INHIBITORS | Merck & Co., Inc. (a New Jersey corp.) (US) | 2000-05-24 | — | — | EP | claimed |
| WO-1999064395-A1 | HETEROCYCLIC AMIDE COMPOUNDS AS CELL ADHESION INHIBITORS | MERCK & CO., INC. (US) | 1999-12-16 | — | — | WO | claimed |
| WO-1998053814-A1 | HETEROCYCLIC AMIDE COMPOUNDS AS CELL ADHESION INHIBITORS | MERCK & CO., INC. (US) | 1998-12-03 | — | — | WO | claimed |