Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.49 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.45 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.45 |
| ▸ | CTSK | P43235 | 9/20 | 0.45 |
| ▸ | CTSS | P25774 | 6/20 | 0.45 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.44 |
| ▸ | CTSL | P07711 | 1/20 | 0.44 |
| ▸ | CTSB | P07858 | 1/20 | 0.44 |
| ▸ | ACE | P12821 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.42 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.41 |
| ▸ | PTPRA | P18433 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2480406 | 1.00 | KLK5 (0.49) | KLK5ITGB3ITGA2BCTSKCTSS | |
| SCHEMBL2477418 | 0.92 | CTSS (0.53) | KLK5CTSKCTSSBIRC2CTSL | |
| SCHEMBL2479296 | 0.90 | ITGB3 (0.56) | ITGB3ITGA2BCTSKCTSSCTSL | |
| SCHEMBL22023204 | 0.90 | ITGB3 (0.56) | ITGB3ITGA2BCTSKCTSSCTSL | |
| SCHEMBL8098713 | 0.88 | CTSK (0.49) | KLK5CTSKCTSSCTSLCTSB | |
| SCHEMBL1819429 | 0.85 | CTSK (0.41) | ITGB3ITGA2BCTSKCTSSCTSL | |
| SCHEMBL3536435 | 0.83 | KLK5 (0.55) | KLK5ITGB3ITGA2BCTSKCTSS | |
| SCHEMBL5925862 | 0.83 | KLK5 (0.55) | KLK5ITGB3ITGA2BCTSKCTSS | |
| SCHEMBL5263821 | 0.83 | KLK5 (0.55) | KLK5ITGB3ITGA2BCTSKCTSS | |
| SCHEMBL15593763 | 0.83 | ITGB3 (0.64) | KLK5ITGB3ITGA2BCTSKCTSS |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012054782-A2 | FLUOROALKOXYLATION OF ORGANIC COMPOUNDS | PRESIDENTS AND FELLOWS OF HARVARD COLLEGE (US) | 2012-04-26 | — | — | WO | disclosed |