Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRG2 | P18507 | 2/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.39 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.39 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.39 |
| ▸ | KLK7 | P49862 | 6/20 | 0.35 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.34 |
| ▸ | PLA2G5 | P39877 | 1/20 | 0.34 |
| ▸ | ITGB3 | P05106 | 5/20 | 0.33 |
| ▸ | ITGA2B | P08514 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ITGAV | P06756 | 3/20 | 0.33 |
| ▸ | KLK5 | Q9Y337 | 5/20 | 0.32 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.32 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.32 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7366878 | 0.89 | ITGB3 (0.38) | KLK7ITGB3ITGA2BITGAV | |
| SCHEMBL8468002 | 0.84 | DHODH (0.37) | KLK7PLA2G10PLA2G5ITGB3ITGA2B | |
| SCHEMBL8323234 | 0.84 | KLK7 (0.36) | KLK7PLA2G10PLA2G5ITGB3ITGA2B | |
| SCHEMBL8467321 | 0.82 | GABRA1 (0.35) | GABRG2GABRB3GABRA5GABRA1GABRA3 | |
| SCHEMBL7919362 | 0.82 | ITGB3 (0.35) | GABRG2GABRB3GABRA5GABRA1GABRA3 | |
| SCHEMBL8328325 | 0.76 | ITGB3 (0.40) | ITGB3ITGA2BMEN1KMT2AITGAV | |
| SCHEMBL8330616 | 0.75 | ITGB3 (0.46) | ITGB3ITGA2BITGAV | |
| SCHEMBL29294080 | 0.74 | ACE (0.38) | — | |
| SCHEMBL7544674 | 0.73 | ITGB3 (0.39) | ITGB3ITGA2BITGAV | |
| SCHEMBL7798122 | 0.71 | HSD17B3 (0.39) | ITGB3ITGA2BITGAV |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0869787-A4 | VITRONECTIN RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM CORP (US) | 1999-03-24 | — | — | EP | disclosed |
| EP-0869787-A1 | VITRONECTIN RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 1998-10-14 | — | — | EP | disclosed |
| WO-1997024119-A1 | VITRONECTIN RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 1997-07-10 | — | — | WO | disclosed |