Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | NAE1 | Q13564 | 1/20 | 0.38 |
| ▸ | UBA3 | Q8TBC4 | 1/20 | 0.38 |
| ▸ | ITGB3 | P05106 | 4/20 | 0.37 |
| ▸ | PRSS1 | P07477 | 4/20 | 0.37 |
| ▸ | PRSS2 | P07478 | 4/20 | 0.37 |
| ▸ | ITGA2B | P08514 | 4/20 | 0.37 |
| ▸ | PRSS3 | P35030 | 4/20 | 0.37 |
| ▸ | F10 | P00742 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6601789 | 0.89 | GRM2 (0.45) | GRM2ITGB3PRSS1PRSS2ITGA2B | |
| SCHEMBL6600722 | 0.89 | GRM2 (0.45) | GRM2ITGB3PRSS1PRSS2ITGA2B | |
| SCHEMBL6600718 | 0.89 | GRM2 (0.45) | GRM2ITGB3PRSS1PRSS2ITGA2B | |
| SCHEMBL7631925 | 0.89 | ITGB3 (0.53) | GRM2ITGB3PRSS1PRSS2ITGA2B | |
| SCHEMBL7638635 | 0.88 | ITGB3 (0.48) | ITGB3PRSS1PRSS2ITGA2BPRSS3 | |
| SCHEMBL7640299 | 0.88 | ITGB3 (0.43) | ALDH1A1TSHRITGB3ITGA2BF10 | |
| SCHEMBL7640396 | 0.87 | ITGB3 (0.43) | ITGB3PRSS1PRSS2ITGA2BPRSS3 | |
| SCHEMBL7639718 | 0.87 | ITGB3 (0.39) | ALDH1A1TSHRITGB3PRSS1PRSS2 | |
| SCHEMBL7640285 | 0.86 | ITGB3 (0.42) | ITGB3PRSS1PRSS2ITGA2BPRSS3 | |
| SCHEMBL7633585 | 0.86 | ITGB3 (0.38) | ALDH1A1TSHRITGB3PRSS1PRSS2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0741133-B1 | Adhesion receptor antagonists | MERCK PATENT GMBH (DE) | 2004-01-28 | — | — | EP | disclosed |
| EP-0741133-A2 | Adhesion receptor antagonists | MERCK PATENT GmbH (DE) | 1996-11-06 | — | — | EP | disclosed |