Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 2/20 | 0.34 |
| ▸ | CTSB | P07858 | 2/20 | 0.34 |
| ▸ | CTSS | P25774 | 2/20 | 0.34 |
| ▸ | CTSK | P43235 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.32 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.32 |
| ▸ | UCHL1 | P09936 | 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 | |
|---|---|---|---|---|
| SCHEMBL695593 | 0.87 | MEN1 (0.33) | CTSLCTSBCTSSCTSKKMT2A | |
| SCHEMBL695841 | 0.80 | MEN1 (0.32) | CTSKKMT2AMEN1ALDH1A1MAPT | |
| SCHEMBL15200625 | 0.79 | CYP1A2 (0.43) | CTSKKMT2AMEN1ALDH1A1MAPT | |
| SCHEMBL695599 | 0.79 | CYP1A2 (0.43) | CTSKKMT2AMEN1ALDH1A1MAPT | |
| SCHEMBL696865 | 0.78 | CTSS (0.41) | CTSLCTSBCTSSCTSKUCHL1 | |
| SCHEMBL696541 | 0.78 | UCHL1 (0.37) | KMT2AMEN1ALDH1A1MAPTNR1H2 | |
| SCHEMBL694346 | 0.77 | STS (0.44) | CTSLCTSBCTSSCTSKUCHL1 | |
| SCHEMBL15202523 | 0.77 | STS (0.44) | CTSLCTSBCTSSCTSKKMT2A | |
| SCHEMBL695674 | 0.77 | CTSS (0.40) | CTSLCTSBCTSSCTSKUCHL1 | |
| SCHEMBL695061 | 0.76 | CTSS (0.44) | CTSLCTSBCTSSCTSK |
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-2421826-A1 | PROLINE DERIVATIVES AS CATHEPSIN INHIBITORS | F. Hoffmann-La Roche AG (CH) | 2012-02-29 | — | — | EP | disclosed |
| WO-2010121918-A1 | PROLINE DERIVATIVES AS CATHEPSIN INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-10-28 | — | — | WO | disclosed |