Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 1/20 | 0.57 |
| ▸ | CTSB | P07858 | 1/20 | 0.57 |
| ▸ | CTSS | P25774 | 1/20 | 0.57 |
| ▸ | CTSD | P07339 | 7/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | REN | P00797 | 2/20 | 0.54 |
| ▸ | BACE1 | P56817 | 1/20 | 0.53 |
| ▸ | SYK | P43405 | 1/20 | 0.53 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.52 |
| ▸ | CASP3 | P42574 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7269133 | 0.92 | CTSB (0.65) | CTSLCTSBCTSSCTSDMEN1 | |
| SCHEMBL6447745 | 0.91 | CTSD (0.66) | CTSDBACE1KLK5 | |
| SCHEMBL7270278 | 0.90 | CTSD (0.67) | CTSDBACE1SYKKLK5 | |
| SCHEMBL6448856 | 0.90 | CTSB (0.65) | CTSLCTSBCTSSCTSDMEN1 | |
| SCHEMBL6449655 | 0.89 | CTSD (0.66) | CTSDBACE1KLK5 | |
| SCHEMBL15095216 | 0.88 | CTSD (0.67) | CTSDBACE1SYKKLK5 | |
| SCHEMBL6931617 | 0.85 | KLK5 (0.59) | CTSLCTSBCTSSCTSDSYK | |
| SCHEMBL7430958 | 0.84 | BACE1 (0.61) | CTSDBACE1KLK5 | |
| SCHEMBL19696469 | 0.84 | CTSD (0.59) | CTSLCTSBCTSSCTSDREN | |
| SCHEMBL17770751 | 0.84 | CTSD (0.59) | CTSLCTSBCTSSCTSDREN |
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-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-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 |