Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSD | P07339 | 3/20 | 0.66 |
| ▸ | KLK5 | Q9Y337 | 2/20 | 0.59 |
| ▸ | PSEN1 | P49768 | 3/20 | 0.54 |
| ▸ | PSEN2 | P49810 | 3/20 | 0.54 |
| ▸ | APH1B | Q8WW43 | 3/20 | 0.54 |
| ▸ | NCSTN | Q92542 | 3/20 | 0.54 |
| ▸ | APH1A | Q96BI3 | 3/20 | 0.54 |
| ▸ | PSENEN | Q9NZ42 | 3/20 | 0.54 |
| ▸ | BACE1 | P56817 | 3/20 | 0.53 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL15095216 | 0.99 | CTSD (0.67) | CTSDKLK5PSEN1PSEN2APH1B | |
| SCHEMBL6447745 | 0.98 | CTSD (0.66) | CTSDKLK5PSEN1PSEN2APH1B | |
| SCHEMBL7270278 | 0.97 | CTSD (0.67) | CTSDKLK5PSEN1PSEN2APH1B | |
| SCHEMBL7430958 | 0.94 | BACE1 (0.61) | CTSDKLK5BACE1 | |
| SCHEMBL7443260 | 0.94 | CTSD (0.59) | CTSDKLK5PSEN1PSEN2APH1B | |
| SCHEMBL9533710 | 0.94 | CTSD (0.59) | CTSDKLK5PSEN1PSEN2APH1B | |
| SCHEMBL9237792 | 0.93 | CTSD (0.58) | CTSDKLK5PSEN1PSEN2APH1B | |
| SCHEMBL9237787 | 0.93 | CTSD (0.58) | CTSDKLK5PSEN1PSEN2APH1B | |
| SCHEMBL8531207 | 0.93 | KLK5 (0.61) | CTSDKLK5PSEN1PSEN2APH1B | |
| SCHEMBL8532173 | 0.93 | KLK5 (0.61) | CTSDKLK5PSEN1PSEN2APH1B |
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-0839798-B1 | Intermediates for preparating non-peptide retroviral protease inhibitors | ABBOTT LAB (US) | 2005-08-17 | — | — | EP | disclosed |
| EP-0839798-A2 | Intermediates for preparating non-peptide retroviral protease inhibitors | ABBOTT LABORATORIES (US) | 1998-05-06 | — | — | EP | disclosed |
| US-5545750-A | TREATING HUMAN IMMUNODEFICIENCY VIRUS | ABBOTT LABORATORIES (US) | 1996-08-13 | — | — | US | disclosed |
| EP-0402646-A1 | Retroviral protease inhibiting compounds | ABBOTT LABORATORIES (US) | 1990-12-19 | — | — | EP | disclosed |