Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.59 |
| ▸ | ATM | Q13315 | 1/20 | 0.59 |
| ▸ | CTSL | P07711 | 4/20 | 0.58 |
| ▸ | CTSS | P25774 | 4/20 | 0.58 |
| ▸ | CTSK | P43235 | 4/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.57 |
| ▸ | F2 | P00734 | 1/20 | 0.56 |
| ▸ | ITGB3 | P05106 | 6/20 | 0.56 |
| ▸ | ITGA2B | P08514 | 6/20 | 0.56 |
| ▸ | CTSB | P07858 | 2/20 | 0.55 |
| ▸ | TACR1 | P25103 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL4980616 | 0.90 | TACR1 (0.62) | CTSLCTSSCTSKALDH1A1ALOX15 | |
| SCHEMBL6439753 | 0.90 | TACR1 (0.62) | CTSLCTSSCTSKALDH1A1ALOX15 | |
| SCHEMBL7490981 | 0.90 | TACR1 (0.62) | CTSLCTSSCTSKALDH1A1ALOX15 | |
| SCHEMBL7039089 | 0.88 | ATM (0.67) | HDAC8ATMCTSLCTSSCTSK | |
| SCHEMBL9716776 | 0.88 | ATM (0.67) | HDAC8ATMCTSLCTSSCTSK | |
| SCHEMBL2406036 | 0.88 | ALDH1A1 (0.65) | HDAC8ATMCTSLCTSSCTSK | |
| SCHEMBL7044293 | 0.88 | ATM (0.67) | HDAC8ATMCTSLCTSSCTSK | |
| SCHEMBL8569421 | 0.88 | ALDH1A1 (0.65) | HDAC8ATMCTSLCTSSCTSK | |
| SCHEMBL9716778 | 0.88 | ATM (0.67) | HDAC8ATMCTSLCTSSCTSK | |
| SCHEMBL7044299 | 0.88 | ATM (0.67) | HDAC8ATMCTSLCTSSCTSK |
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 |
|---|---|---|---|---|---|---|---|
| US-5652369-A | PROTEASE INHIBITOR | HOFFMANN-LA ROCHE INC. (US) | 1997-07-29 | — | — | US | disclosed |
| US-5620987-A | Amino acid derivatives | HOFFMANN-LA ROCHE INC. (US) | 1997-04-15 | — | — | US | disclosed |
| US-5554756-A | PROTEASE INHIBITOR | HOFFMANN-LA ROCHE INC. (US) | 1996-09-10 | — | — | US | disclosed |
| US-5446161-A | Protease inhibitor, viricides | HOFFMANN-LA ROCHE INC. (US) | 1995-08-29 | — | — | US | disclosed |
| EP-0346847-B1 | Amino acid derivatives | HOFFMANN LA ROCHE (CH) | 1994-05-11 | — | — | EP | disclosed |
| US-5157041-A | Viricides | HOFFMANN-LA ROCHE INC. (US) | 1992-10-20 | — | — | US | disclosed |
| EP-0346847-A2 | Amino acid derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1989-12-20 | — | — | EP | disclosed |