Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | PRKCG | P05129 | 1/20 | 0.36 |
| ▸ | PRKCA | P17252 | 1/20 | 0.36 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | ACE | P12821 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7333012 | 0.83 | TSHR (0.39) | ALDH1A1KDM4EPOLBTSHRSMN1; SMN2 | |
| SCHEMBL7397950 | 0.77 | ALDH1A1 (0.52) | ALDH1A1KDM4EPOLBTSHRSMN1; SMN2 | |
| SCHEMBL7919242 | 0.68 | TSHR (0.43) | ALDH1A1KDM4EPOLBTSHRSMN1; SMN2 | |
| SCHEMBL7078805 | 0.68 | TSHR (0.43) | ALDH1A1KDM4EPOLBTSHRSMN1; SMN2 | |
| SCHEMBL7401266 | 0.68 | TSHR (0.43) | ALDH1A1KDM4EPOLBTSHRSMN1; SMN2 | |
| SCHEMBL7366389 | 0.68 | TSHR (0.43) | ALDH1A1KDM4EPOLBTSHRSMN1; SMN2 | |
| SCHEMBL7057266 | 0.67 | HDAC8 (0.62) | ALDH1A1KDM4EPOLBTSHRSMN1; SMN2 | |
| SCHEMBL6007674 | 0.67 | HDAC8 (0.62) | ALDH1A1KDM4EPOLBTSHRSMN1; SMN2 | |
| SCHEMBL5956018 | 0.67 | CA12 (0.40) | SMN1; SMN2HSD17B3PRKCGPRKCAPRKCD | |
| SCHEMBL13957388 | 0.66 | ACE (0.57) | ACE |
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 |