Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 5/20 | 0.35 |
| ▸ | CTSS | P25774 | 4/20 | 0.35 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA3 | P07451 | 1/20 | 0.31 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
| ▸ | CA6 | P23280 | 1/20 | 0.31 |
| ▸ | CA5A | P35218 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.31 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.31 |
| ▸ | CTSL | P07711 | 1/20 | 0.31 |
| ▸ | CTSB | P07858 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19578484 | 0.91 | CTSK (0.33) | CTSKCTSS | |
| SCHEMBL19334205 | 0.86 | CTSK (0.35) | CTSKCTSSCA12CA1CA2 | |
| SCHEMBL19578131 | 0.86 | CTSK (0.40) | CTSKCTSSCAPN1CA1CA2 | |
| SCHEMBL8906249 | 0.84 | CTSS (0.34) | CTSKCTSSCA12CA1CA2 | |
| SCHEMBL19318525 | 0.84 | CTSS (0.34) | CTSKCTSSCA12CA1CA2 | |
| SCHEMBL19578133 | 0.80 | CTSK (0.35) | CTSKCTSSCA12CA1CA2 | |
| SCHEMBL19578346 | 0.79 | SMN1; SMN2 (0.34) | CTSKCTSS | |
| SCHEMBL19578425 | 0.77 | CTSK (0.36) | CTSKCTSSCA1CA2 | |
| SCHEMBL8916705 | 0.74 | CA12 (0.34) | CTSKCTSSCA12CA1CA2 | |
| SCHEMBL16511498 | 0.74 | BIRC2 (0.38) | CTSKCA12CA1CA2CA3 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9758487-B2 | Hepatitis C virus inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 2017-09-12 | — | — | US | disclosed |