Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSD | P07339 | 5/20 | 0.74 |
| ▸ | REN | P00797 | 2/20 | 0.51 |
| ▸ | CTSE | P14091 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.39 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.39 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.39 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | TACR2 | P21452 | 1/20 | 0.39 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8801445 | 0.94 | CTSD (0.70) | CTSDRENCTSEALDH1A1TSHR | |
| SCHEMBL8800567 | 0.92 | CTSD (0.61) | CTSDRENCTSEALDH1A1TSHR | |
| SCHEMBL8800871 | 0.89 | CTSD (0.86) | CTSDRENCTSEALDH1A1CYP3A4 | |
| SCHEMBL8800288 | 0.87 | CTSD (0.73) | CTSDRENCTSEALDH1A1CYP3A4 | |
| SCHEMBL8802750 | 0.87 | CTSD (0.76) | CTSDRENCTSEALDH1A1CYP3A4 | |
| SCHEMBL8801929 | 0.87 | CTSD (0.82) | CTSDRENCTSEALDH1A1CYP3A4 | |
| SCHEMBL7313674 | 0.84 | CTSD (0.80) | CTSDRENCTSEALDH1A1CYP3A4 | |
| SCHEMBL8801937 | 0.83 | CTSD (0.78) | CTSDRENCTSEALDH1A1CYP3A4 | |
| SCHEMBL8801592 | 0.82 | CTSD (0.77) | CTSDRENCTSEALDH1A1CYP3A4 | |
| SCHEMBL8801485 | 0.82 | CTSD (0.68) | CTSDRENCTSEALDH1A1CYP3A4 |
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-0601486-B1 | Cis-epoxide derivatives useful as irreversible HIV protease inhibitors and process and intermediates for their preparation | LUCKY LTD (KR) | 1997-10-29 | — | — | EP | claimed |
| EP-0601486-A1 | Cis-epoxide derivatives useful as irreversible HIV protease inhibitors and process and intermediates for their preparation | LUCKY LTD. (KR) | 1994-06-15 | — | — | EP | claimed |