Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLK5 | Q9Y337 | 3/20 | 0.55 |
| ▸ | PSEN1 | P49768 | 6/20 | 0.53 |
| ▸ | PSEN2 | P49810 | 6/20 | 0.53 |
| ▸ | APH1B | Q8WW43 | 6/20 | 0.53 |
| ▸ | NCSTN | Q92542 | 6/20 | 0.53 |
| ▸ | APH1A | Q96BI3 | 6/20 | 0.53 |
| ▸ | PSENEN | Q9NZ42 | 6/20 | 0.53 |
| ▸ | APP | P05067 | 1/20 | 0.53 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.51 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.51 |
| ▸ | BCHE | P06276 | 2/20 | 0.48 |
| ▸ | REN | P00797 | 2/20 | 0.48 |
| ▸ | BACE1 | P56817 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | ACE | P12821 | 1/20 | 0.44 |
| ▸ | TACR1 | P25103 | 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 | |
|---|---|---|---|---|
| SCHEMBL7627289 | 1.00 | KLK5 (0.55) | KLK5PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL7636668 | 0.90 | KLK5 (0.53) | KLK5PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL7636665 | 0.90 | KLK5 (0.53) | KLK5PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL7631860 | 0.89 | KLK5 (0.52) | KLK5PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL7631855 | 0.89 | KLK5 (0.52) | KLK5PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL7635269 | 0.89 | KLK5 (0.52) | KLK5PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL7635266 | 0.89 | KLK5 (0.52) | KLK5PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL7439457 | 0.88 | PSEN1 (0.63) | KLK5PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL7439460 | 0.88 | PSEN1 (0.63) | KLK5PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL7635798 | 0.87 | PSEN1 (0.54) | KLK5PSEN1PSEN2APH1BNCSTN |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0708085-B1 | Antiviral ethers of aspartate protease substrate isosteres | NOVARTIS AG (CH) | 2002-07-17 | — | — | EP | disclosed |
| US-5935976-A | Antiviral ethers of aspartate protease substrate isosteres | NOVARTIS CORPORATION (US) | 1999-08-10 | — | — | US | disclosed |
| US-5807891-A | RETROVIRUSES | NOVARTIS AG (CH) | 1998-09-15 | — | — | US | disclosed |
| US-5663200-A | CARBAMOYL PEPTIDE DERIVATIVES AS VIRICIDES | CIBA-GEIGY CORPORATION (US) | 1997-09-02 | — | — | US | disclosed |
| US-5643878-A | TREATMENT OF RETROVIRAL DISEASES LIKE AIDS | CIBA-GEIGY CORPORATION (US) | 1997-07-01 | — | — | US | disclosed |
| EP-0708085-A2 | Antiviral ethers of aspartate protease substrate isosteres | CIBA-GEIGY AG (CH) | 1996-04-24 | — | — | EP | disclosed |
| EP-0618222-A2 | Dipeptid derivatives of 5-amino-4-hydroxy-hexanoic acid | CIBA-GEIGY AG (CH) | 1994-10-05 | — | — | EP | disclosed |