Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 8/20 | 0.62 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.62 |
| ▸ | CTSB | P07858 | 13/20 | 0.61 |
| ▸ | CTSK | P43235 | 6/20 | 0.60 |
| ▸ | CTSS | P25774 | 3/20 | 0.60 |
| ▸ | ELANE | P08246 | 2/20 | 0.60 |
| ▸ | CTSV | O60911 | 1/20 | 0.60 |
| ▸ | PLG | P00747 | 1/20 | 0.60 |
| ▸ | CMA1 | P23946 | 1/20 | 0.60 |
| ▸ | CELA1 | Q9UNI1 | 1/20 | 0.60 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL13062724 | 1.00 | CTSL (0.62) | CTSLABCG2CTSBCTSKCTSS | |
| SCHEMBL8279522 | 1.00 | CTSL (0.62) | CTSLABCG2CTSBCTSKCTSS | |
| SCHEMBL8280314 | 0.92 | CTSL (0.61) | CTSLABCG2CTSBCTSKCTSS | |
| SCHEMBL8280326 | 0.91 | ABCG2 (0.65) | CTSLABCG2CTSBCTSKCTSS | |
| SCHEMBL13062896 | 0.90 | CTSL (0.53) | CTSLABCG2CTSBCTSKCTSS | |
| SCHEMBL13413337 | 0.90 | CTSL (0.53) | CTSLABCG2CTSBCTSKCTSS | |
| SCHEMBL10077204 | 0.90 | CTSL (0.77) | CTSLABCG2CTSBCTSKCTSS | |
| SCHEMBL13245534 | 0.90 | CTSL (0.77) | CTSLABCG2CTSBCTSKCTSS | |
| SCHEMBL13267073 | 0.90 | CTSL (0.77) | CTSLABCG2CTSBCTSKCTSS | |
| SCHEMBL13245467 | 0.90 | CTSL (0.77) | CTSLABCG2CTSBCTSKCTSS |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7683033-B2 | Inhibitors of serine proteases, particularly HCV NS3-NS4A protease | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2010-03-23 | — | — | US | disclosed |
| US-7683033-B2 | Inhibitors of serine proteases, particularly HCV NS3-NS4A protease | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2010-03-23 | — | — | US | disclosed |