Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 2/20 | 0.41 |
| ▸ | CTSS | P25774 | 8/20 | 0.41 |
| ▸ | CTSK | P43235 | 7/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.40 |
| ▸ | RELA | Q04206 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.37 |
| ▸ | CTSB | P07858 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.37 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1965017 | 1.00 | CTSL (0.41) | CTSLCTSSCTSKNFKB1NFKB2 | |
| SCHEMBL25076194 | 0.94 | CTSL (0.43) | CTSLCTSSCTSKNFKB1NFKB2 | |
| SCHEMBL2341125 | 0.89 | CTSS (0.42) | CTSLCTSSCTSKCTSBITGB3 | |
| SCHEMBL6908367 | 0.89 | CTSS (0.42) | CTSLCTSSCTSKCTSBITGB3 | |
| SCHEMBL1965485 | 0.89 | CTSS (0.42) | CTSLCTSSCTSKCTSBITGB3 | |
| SCHEMBL25175778 | 0.88 | CTSL (0.43) | CTSLCTSSCTSKNFKB1NFKB2 | |
| SCHEMBL1962816 | 0.86 | CTSS (0.42) | CTSLCTSSCTSKCTSBITGB3 | |
| SCHEMBL8230099 | 0.84 | CTSL (0.42) | CTSLCTSSCTSKNFKB1NFKB2 | |
| SCHEMBL5327858 | 0.84 | CTSL (0.42) | CTSLCTSSCTSKNFKB1NFKB2 | |
| SCHEMBL6907732 | 0.84 | CTSS (0.44) | CTSLCTSSCTSKNFKB1NFKB2 |
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-8815809-B2 | Cysteine protease inhibitors | MEDIVIR UK LTD (GB) | 2014-08-26 | — | — | US | disclosed |