Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | PTGFR | P43088 | 1/20 | 0.44 |
| ▸ | ITGB1 | P05556 | 7/20 | 0.42 |
| ▸ | ITGA5 | P08648 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.42 |
| ▸ | ITGA4 | P13612 | 6/20 | 0.42 |
| ▸ | ITGB7 | P26010 | 4/20 | 0.41 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.41 |
| ▸ | ITGAV | P06756 | 2/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ACE | P12821 | 1/20 | 0.40 |
| ▸ | KIFC1 | Q9BW19 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6368647 | 0.91 | HSD11B1 (0.50) | TSHRPTGFRITGB1ITGA5HSD11B1 | |
| SCHEMBL6373870 | 0.88 | ITGA4 (0.53) | KMT2APTGFRITGB1ITGA5HSD11B1 | |
| SCHEMBL6367902 | 0.85 | ITGB1 (0.59) | ITGB1ITGA5ITGA4ITGB7ITGAV | |
| SCHEMBL6368956 | 0.82 | HSD11B1 (0.45) | PTGFRITGB1ITGA5HSD11B1ITGA4 | |
| SCHEMBL6374122 | 0.82 | HSD11B1 (0.47) | LMNATSHRPTGFRITGB1ITGA5 | |
| SCHEMBL6375296 | 0.80 | ITGA4 (0.54) | ITGB1ITGA5HSD11B1ITGA4ITGB7 | |
| SCHEMBL6368571 | 0.78 | ITGA4 (0.51) | ITGB1ITGA5ITGA4ITGB7 | |
| SCHEMBL3385855 | 0.78 | ALDH1A1 (0.54) | KMT2APTGFRITGB1ITGA5ITGA4 | |
| SCHEMBL630186 | 0.77 | ITGB1 (0.56) | ITGB1ITGA5ITGA4ITGB7ITGAV | |
| SCHEMBL630187 | 0.77 | ITGB1 (0.56) | 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 |