Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK3 | P52333 | 1/20 | 0.58 |
| ▸ | BTK | Q06187 | 1/20 | 0.58 |
| ▸ | PPARA | Q07869 | 7/20 | 0.47 |
| ▸ | PPARG | P37231 | 6/20 | 0.47 |
| ▸ | PPARD | Q03181 | 2/20 | 0.46 |
| ▸ | MMP13 | P45452 | 1/20 | 0.45 |
| ▸ | CTSS | P25774 | 4/20 | 0.43 |
| ▸ | CTSK | P43235 | 3/20 | 0.43 |
| ▸ | CTSL | P07711 | 1/20 | 0.43 |
| ▸ | CTSB | P07858 | 1/20 | 0.43 |
| ▸ | ACE | P12821 | 1/20 | 0.42 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.41 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.41 |
| ▸ | RELA | Q04206 | 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 | |
|---|---|---|---|---|
| SCHEMBL5226599 | 0.88 | JAK3 (0.51) | JAK3BTKPPARAPPARGPPARD | |
| SCHEMBL7449431 | 0.85 | PPARA (0.67) | JAK3BTKPPARAPPARGPPARD | |
| SCHEMBL18549279 | 0.84 | JAK3 (0.56) | JAK3BTKPPARAPPARGPPARD | |
| SCHEMBL17028420 | 0.84 | JAK3 (0.56) | JAK3BTKPPARAPPARGPPARD | |
| SCHEMBL12617667 | 0.84 | JAK3 (0.56) | JAK3BTKPPARAPPARGPPARD | |
| SCHEMBL2951876 | 0.84 | NFKB1 (0.53) | PPARAPPARGPPARDMMP13CTSS | |
| SCHEMBL2948733 | 0.84 | NFKB1 (0.53) | PPARAPPARGPPARDMMP13CTSS | |
| SCHEMBL4671738 | 0.84 | PPARA (0.64) | PPARAPPARGPPARDMMP13CTSS | |
| SCHEMBL5142486 | 0.84 | PPARA (0.64) | PPARAPPARGPPARDMMP13CTSS | |
| SCHEMBL4671732 | 0.84 | PPARA (0.64) | PPARAPPARGPPARDMMP13CTSS |
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 |
|---|---|---|---|---|---|---|---|
| EP-0604183-B1 | Inhibitors of HIV protease useful for the treatment of aids | LILLY CO ELI (US) | 1997-03-05 | — | — | EP | disclosed |
| US-5514802-A | Intermediates for preparing HIV protease inhibitors | ELI LILLY AND COMPANY (US) | 1996-05-07 | — | — | US | disclosed |
| US-5475136-A | Inhibitors of HIV protease useful for the treatment of AIDS | ELI LILLY AND COMPANY (US) | 1995-12-12 | — | — | US | disclosed |
| EP-0604183-A1 | Inhibitors of HIV protease useful for the treatment of aids | ELI LILLY AND COMPANY (US) | 1994-06-29 | — | — | EP | disclosed |