Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 13/20 | 0.40 |
| ▸ | ITGA2B | P08514 | 13/20 | 0.40 |
| ▸ | GRN | P28799 | 1/20 | 0.39 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.39 |
| ▸ | ACE | P12821 | 2/20 | 0.38 |
| ▸ | ACE2 | Q9BYF1 | 2/20 | 0.38 |
| ▸ | CTSK | P43235 | 2/20 | 0.38 |
| ▸ | CTSS | P25774 | 1/20 | 0.38 |
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
| ▸ | CTSB | P07858 | 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 | |
|---|---|---|---|---|
| SCHEMBL2456560 | 0.95 | ITGB3 (0.42) | ITGB3ITGA2BGRNSORT1ACE | |
| SCHEMBL6984792 | 0.95 | ITGB3 (0.42) | ITGB3ITGA2BGRNSORT1ACE | |
| SCHEMBL5503179 | 0.89 | CTSK (0.45) | ITGB3ITGA2BGRNSORT1ACE | |
| SCHEMBL4263662 | 0.88 | CTSK (0.47) | ITGB3ITGA2BGRNSORT1ACE | |
| SCHEMBL3655317 | 0.88 | CTSK (0.47) | ITGB3ITGA2BGRNSORT1ACE | |
| SCHEMBL16461182 | 0.86 | ITGB3 (0.41) | ITGB3ITGA2BACEACE2 | |
| SCHEMBL28951180 | 0.84 | CTSK (0.46) | GRNSORT1CTSKCTSSCTSL | |
| SCHEMBL25523518 | 0.84 | CTSK (0.46) | GRNSORT1CTSKCTSSCTSL | |
| SCHEMBL6987278 | 0.83 | CNR2 (0.39) | ITGB3ITGA2BACEACE2CTSK | |
| SCHEMBL28951061 | 0.83 | CTSK (0.46) | GRNSORT1CTSKCTSSCTSL |
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-2300462-A1 | MACROCYCLIC UREA AND SULFAMIDE DERIVATIVES AS INHIBITORS OF TAFIA | Sanofi-aventis (FR) | 2011-03-30 | — | — | EP | disclosed |
| WO-2009146802-A1 | MACROCYCLIC UREA AND SULFAMIDE DERIVATIVES AS INHIBITORS OF TAFIA | SANOFI-AVENTIS (FR) | 2009-12-10 | — | — | WO | disclosed |