Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLK5 | Q9Y337 | 2/20 | 0.55 |
| ▸ | BACE1 | P56817 | 3/20 | 0.49 |
| ▸ | CTSD | P07339 | 2/20 | 0.49 |
| ▸ | PSEN1 | P49768 | 6/20 | 0.49 |
| ▸ | PSEN2 | P49810 | 6/20 | 0.49 |
| ▸ | APH1B | Q8WW43 | 6/20 | 0.49 |
| ▸ | NCSTN | Q92542 | 6/20 | 0.49 |
| ▸ | APH1A | Q96BI3 | 6/20 | 0.49 |
| ▸ | PSENEN | Q9NZ42 | 6/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL7268902 | 0.85 | KLK5 (0.61) | KLK5BACE1CTSDPSEN1PSEN2 | |
| SCHEMBL8531207 | 0.84 | KLK5 (0.61) | KLK5BACE1CTSDPSEN1PSEN2 | |
| SCHEMBL8532173 | 0.84 | KLK5 (0.61) | KLK5BACE1CTSDPSEN1PSEN2 | |
| SCHEMBL8540506 | 0.83 | BACE1 (0.58) | KLK5BACE1CTSD | |
| SCHEMBL6447745 | 0.82 | CTSD (0.66) | KLK5BACE1CTSDPSEN1PSEN2 | |
| SCHEMBL7270592 | 0.82 | KLK5 (0.63) | KLK5PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL9848360 | 0.82 | KLK5 (0.63) | KLK5PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL7334914 | 0.81 | KLK5 (0.57) | KLK5BACE1CTSDPSEN1PSEN2 | |
| SCHEMBL7270278 | 0.81 | CTSD (0.67) | KLK5BACE1CTSDPSEN1PSEN2 | |
| SCHEMBL6449655 | 0.80 | CTSD (0.66) | KLK5BACE1CTSDPSEN1PSEN2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0839798-A2 | Intermediates for preparating non-peptide retroviral protease inhibitors | ABBOTT LABORATORIES (US) | 1998-05-06 | — | — | EP | disclosed |
| US-5670675-A | Retroviral protease inhibiting compounds | ABBOTT LABORATORIES (US) | 1997-09-23 | — | — | US | disclosed |
| US-5545750-A | TREATING HUMAN IMMUNODEFICIENCY VIRUS | ABBOTT LABORATORIES (US) | 1996-08-13 | — | — | US | disclosed |
| US-5142056-A | Human immunodeficiency virus protease inhibitor | ABBOTT LABORATORIES (US) | 1992-08-25 | — | — | US | disclosed |
| EP-0402646-A1 | Retroviral protease inhibiting compounds | ABBOTT LABORATORIES (US) | 1990-12-19 | — | — | EP | disclosed |