Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FKBP1A | P62942 | 6/20 | 0.67 |
| ▸ | ITGB1 | P05556 | 4/20 | 0.54 |
| ▸ | ITGA5 | P08648 | 2/20 | 0.54 |
| ▸ | MMP8 | P22894 | 4/20 | 0.53 |
| ▸ | MMP12 | P39900 | 2/20 | 0.53 |
| ▸ | MMP13 | P45452 | 2/20 | 0.53 |
| ▸ | MMP1 | P03956 | 1/20 | 0.53 |
| ▸ | MMP7 | P09237 | 1/20 | 0.53 |
| ▸ | ITGA4 | P13612 | 2/20 | 0.52 |
| ▸ | ACE | P12821 | 3/20 | 0.50 |
| ▸ | ACE2 | Q9BYF1 | 3/20 | 0.50 |
| ▸ | ITGA2 | P17301 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | TACR1 | P25103 | 1/20 | 0.47 |
| ▸ | MMP3 | P08254 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7066815 | 0.96 | FKBP1A (0.61) | FKBP1AITGB1ITGA5MMP8MMP12 | |
| SCHEMBL7707493 | 0.89 | ITGB1 (0.60) | FKBP1AITGB1ITGA5MMP8MMP12 | |
| SCHEMBL7069972 | 0.87 | MMP8 (0.70) | FKBP1AITGB1ITGA5MMP8MMP12 | |
| SCHEMBL7070239 | 0.84 | FKBP1A (0.61) | FKBP1AITGB1ITGA5MMP8MMP12 | |
| SCHEMBL7066929 | 0.83 | ITGB1 (0.61) | ITGB1ITGA5MMP8MMP12MMP13 | |
| SCHEMBL27538863 | 0.83 | ITGB1 (0.61) | ITGB1ITGA5MMP8MMP12MMP13 | |
| SCHEMBL27565203 | 0.83 | ITGB1 (0.63) | FKBP1AITGB1ITGA5MMP8MMP12 | |
| SCHEMBL5686774 | 0.83 | ITGB1 (0.56) | FKBP1AITGB1ITGA5MMP8MMP12 | |
| SCHEMBL6665448 | 0.82 | ACE (0.52) | ITGB1ITGA5ACEACE2ALDH1A1 | |
| SCHEMBL6665446 | 0.82 | ACE (0.52) | ITGB1ITGA5ACEACE2ALDH1A1 |
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 5 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 |
| 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 |