Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.56 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.56 |
| ▸ | CCR1 | P32246 | 1/20 | 0.51 |
| ▸ | CTSK | P43235 | 5/20 | 0.45 |
| ▸ | CTSB | P07858 | 6/20 | 0.44 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.43 |
| ▸ | CTSL | P07711 | 8/20 | 0.42 |
| ▸ | CTSS | P25774 | 6/20 | 0.42 |
| ▸ | CTSV | O60911 | 2/20 | 0.41 |
| ▸ | PLK1 | P53350 | 1/20 | 0.41 |
| ▸ | TACR2 | P21452 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7473345 | 0.93 | TAS1R3 (0.54) | TAS1R3TAS1R1CCR1CTSKCTSB | |
| SCHEMBL6927032 | 0.90 | CCR1 (0.49) | TAS1R3TAS1R1CCR1CTSKCTSB | |
| SCHEMBL6927425 | 0.87 | CTSL (0.55) | CTSKCTSBCTSLCTSSCTSV | |
| SCHEMBL7462272 | 0.85 | CTSL (0.50) | TAS1R3TAS1R1CCR1CTSKCTSB | |
| SCHEMBL6926811 | 0.82 | CTSK (0.48) | CCR1CTSKCTSBCTSLCTSS | |
| SCHEMBL7467137 | 0.81 | TAS1R3 (0.49) | TAS1R3TAS1R1CTSKCTSBCTSL | |
| SCHEMBL7461611 | 0.81 | CTSL (0.47) | TAS1R3TAS1R1CTSKCTSBCTSL | |
| SCHEMBL7164852 | 0.80 | TAS1R3 (0.58) | TAS1R3TAS1R1CCR1CTSKCTSB | |
| SCHEMBL7473976 | 0.80 | CTSL (0.49) | CTSKCTSBCTSLCTSSCTSV | |
| SCHEMBL6927525 | 0.80 | CTSL (0.49) | CTSKCTSBCTSLCTSSCTSV |
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-6518267-B1 | Protease inhibitors | SMITHKLINE BEECHAM CORPORATION | 2003-02-11 | — | — | US | claimed |
| US-6518267-B1 | Protease inhibitors | SMITHKLINE BEECHAM CORPORATION | 2003-02-11 | — | — | US | disclosed |