Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 2/20 | 0.57 |
| ▸ | ITGB3 | P05106 | 3/20 | 0.55 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.55 |
| ▸ | ITGAV | P06756 | 2/20 | 0.55 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.55 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.55 |
| ▸ | CTSS | P25774 | 7/20 | 0.53 |
| ▸ | CTSK | P43235 | 6/20 | 0.53 |
| ▸ | CTSB | P07858 | 4/20 | 0.53 |
| ▸ | CTSL | P07711 | 2/20 | 0.53 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.48 |
| ▸ | PPARA | Q07869 | 2/20 | 0.47 |
| ▸ | PPARG | P37231 | 1/20 | 0.47 |
| ▸ | FPR2 | P25090 | 1/20 | 0.47 |
| ▸ | REN | P00797 | 1/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8422097 | 1.00 | ACE (0.57) | ACEITGB3ITGA2BITGAVITGB1 | |
| SCHEMBL9956406 | 0.90 | ACE (0.63) | ACEITGB3ITGA2BITGAVITGB1 | |
| SCHEMBL9956403 | 0.90 | ACE (0.63) | ACEITGB3ITGA2BITGAVITGB1 | |
| SCHEMBL29145384 | 0.88 | ACE (0.60) | ACEITGB3ITGA2BITGAVITGB1 | |
| SCHEMBL9955380 | 0.88 | ACE (0.60) | ACEITGB3ITGA2BITGAVITGB1 | |
| SCHEMBL9955383 | 0.88 | ACE (0.60) | ACEITGB3ITGA2BITGAVITGB1 | |
| SCHEMBL6679755 | 0.87 | CTSS (0.45) | ACEITGB3ITGA2BITGAVITGB1 | |
| SCHEMBL28680922 | 0.85 | ACE (0.63) | ACEITGB3ITGA2BITGAVITGB1 | |
| SCHEMBL18317997 | 0.82 | ACE (0.61) | ACEITGB3ITGA2BITGAVITGB1 | |
| SCHEMBL31407365 | 0.82 | ACE (0.61) | ACEITGB3ITGA2BITGAVITGB1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5874472-A | Aminoacid derivatives as no synthase inhibitors | GLAXO WELLCOME INC. (US) | 1999-02-23 | — | — | US | disclosed |
| EP-0705257-B1 | AMINOACID DERIVATIVES AS NO SYNTHASE INHIBITORS | WELLCOME FOUND (GB) | 1998-03-11 | — | — | EP | disclosed |
| EP-0705257-A1 | AMINOACID DERIVATIVES AS NO SYNTHASE INHIBITORS | THE WELLCOME FOUNDATION LIMITED (GB) | 1996-04-10 | — | — | EP | disclosed |
| WO-1995000505-A1 | AMINOACID DERIVATIVES AS NO SYNTHASE INHIBITORS | THE WELLCOME FOUNDATION LIMITED (GB) | 1995-01-05 | — | — | WO | disclosed |