Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 14/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.30 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7963510 | 0.85 | MAOA (0.41) | MAOAMAOBITGB3ITGA2B | |
| SCHEMBL7973799 | 0.80 | ALDH1A1 (0.37) | CTSKMAOAMAOBITGB3ITGA2B | |
| SCHEMBL7974877 | 0.77 | MAOA (0.38) | CTSKMAOAMAOB | |
| SCHEMBL28937251 | 0.67 | NAALAD2 (0.39) | CTSKMAOAMAOBITGB3ITGA2B | |
| SCHEMBL7963542 | 0.67 | NAALAD2 (0.39) | CTSKMAOAMAOBITGB3ITGA2B | |
| SCHEMBL7974823 | 0.67 | ALDH1A1 (0.47) | CTSKITGB3ITGA2B | |
| SCHEMBL8189634 | 0.66 | MAOA (0.34) | CTSKMAOAMAOB | |
| SCHEMBL7747684 | 0.65 | CTSK (0.38) | CTSKITGB3ITGA2B | |
| SCHEMBL8194431 | 0.65 | PKM (0.37) | CTSKMAOAMAOB | |
| SCHEMBL7975004 | 0.65 | MAOA (0.46) | MAOAMAOB |
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-2001005748-A1 | OLIGOMERIC AMINO ACID DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | MONSANTO COMPANY (US) | 2001-01-25 | — | — | WO | disclosed |