Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 7/20 | 0.76 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.45 |
| ▸ | CTSS | P25774 | 2/20 | 0.45 |
| ▸ | CTSK | P43235 | 2/20 | 0.45 |
| ▸ | KLK7 | P49862 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | REN | P00797 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL12371560 | 0.90 | CTSL (0.80) | CTSLALDH1A1SMN1; SMN2TSHRCTSS | |
| SCHEMBL12371605 | 0.87 | CTSL (0.79) | CTSLALDH1A1SMN1; SMN2TSHRCTSS | |
| SCHEMBL12370616 | 0.87 | CTSL (0.62) | CTSLALDH1A1SMN1; SMN2TSHRKLK5 | |
| SCHEMBL12371441 | 0.85 | CTSL (0.75) | CTSLALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL12370596 | 0.83 | CTSL (0.73) | CTSLALDH1A1SMN1; SMN2TSHRKLK5 | |
| SCHEMBL12371564 | 0.83 | CTSL (0.73) | CTSLALDH1A1SMN1; SMN2TSHRKLK5 | |
| SCHEMBL12370593 | 0.83 | CTSL (0.73) | CTSLALDH1A1SMN1; SMN2TSHRCTSS | |
| SCHEMBL12370563 | 0.81 | CTSL (0.73) | CTSLALDH1A1SMN1; SMN2TSHRCTSS | |
| SCHEMBL30257292 | 0.81 | CTSL (1.00) | CTSLSMN1; SMN2KLK5CTSSCTSK | |
| SCHEMBL12370557 | 0.81 | CTSL (0.81) | CTSLALDH1A1SMN1; SMN2TSHRCTSS |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009136997-A2 | INHIBITORS OF HUMAN CATHEPSIN L, CATHEPSIN B, AND CATHEPSIN S | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2009-11-12 | — | — | WO | disclosed |