Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 9/20 | 0.53 |
| ▸ | CTSK | P43235 | 8/20 | 0.53 |
| ▸ | CTSB | P07858 | 3/20 | 0.53 |
| ▸ | CTSL | P07711 | 1/20 | 0.53 |
| ▸ | ACE | P12821 | 1/20 | 0.51 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.48 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.48 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.47 |
| ▸ | AKT1 | P31749 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.45 |
| ▸ | HRH2 | P25021 | 2/20 | 0.44 |
| ▸ | HRH1 | P35367 | 2/20 | 0.44 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.44 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL478774 | 0.89 | ACE (0.62) | CTSSCTSKCTSBCTSLACE | |
| SCHEMBL3338649 | 0.89 | ACE (0.62) | CTSSCTSKCTSBCTSLACE | |
| SCHEMBL16658 | 0.89 | ACE (0.62) | CTSSCTSKCTSBCTSLACE | |
| SCHEMBL7433158 | 0.88 | CTSS (0.67) | CTSSCTSKCTSBCTSLACE | |
| SCHEMBL6578977 | 0.88 | CTSS (0.67) | CTSSCTSKCTSBCTSLACE | |
| SCHEMBL6749429 | 0.86 | CTSS (0.52) | CTSSCTSKCTSBCTSLACE | |
| SCHEMBL3364787 | 0.85 | KLK5 (0.57) | CTSSCTSKCTSBCTSLACE | |
| SCHEMBL13538229 | 0.85 | KLK5 (0.57) | CTSSCTSKCTSBCTSLACE | |
| SCHEMBL13541200 | 0.85 | KLK5 (0.57) | CTSSCTSKCTSBCTSLACE | |
| SCHEMBL6752505 | 0.84 | ACE (0.54) | CTSSCTSKCTSBCTSLACE |
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-0604184-B1 | Inhibitors of HIV protease useful for the treatment of aids | LILLY CO ELI (US) | 1997-07-09 | — | — | EP | disclosed |
| US-5554653-A | Inhibitors of HIV protease useful for the treatment of AIDS | ELI LILLY AND COMPANY (US) | 1996-09-10 | — | — | US | disclosed |
| EP-0604184-A1 | Inhibitors of HIV protease useful for the treatment of aids | ELI LILLY AND COMPANY (US) | 1994-06-29 | — | — | EP | disclosed |