Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 13/20 | 0.49 |
| ▸ | IDH1 | O75874 | 2/20 | 0.33 |
| ▸ | PRKD1 | Q15139 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL17008671 | 0.95 | CTSK (0.55) | CTSKIDH1PRKD1 | |
| SCHEMBL17008366 | 0.94 | CTSK (0.49) | CTSKIDH1PRKD1 | |
| SCHEMBL17008382 | 0.93 | CTSK (0.49) | CTSKIDH1PRKD1 | |
| SCHEMBL17008364 | 0.90 | CTSK (0.44) | CTSKIDH1PRKD1 | |
| SCHEMBL17008802 | 0.89 | CTSK (0.63) | CTSK | |
| SCHEMBL17008383 | 0.89 | CTSK (0.43) | CTSKIDH1PRKD1 | |
| SCHEMBL17020305 | 0.89 | CTSK (0.54) | CTSKIDH1 | |
| SCHEMBL17008674 | 0.88 | CTSK (0.42) | CTSKPRKD1 | |
| SCHEMBL18279837 | 0.87 | CTSK (0.48) | CTSKIDH1 | |
| SCHEMBL17020277 | 0.87 | CTSK (0.48) | CTSKIDH1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3104705-A1 | CATHEPSIN CYSTEINE PROTEASE INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2016-12-21 | — | — | EP | claimed |
| WO-2015123089-A1 | CATHEPSIN CYSTEINE PROTEASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2015-08-20 | — | — | WO | claimed |