Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 1/20 | 0.59 |
| ▸ | CAPN2 | P17655 | 1/20 | 0.59 |
| ▸ | CTSK | P43235 | 7/20 | 0.54 |
| ▸ | CTSS | P25774 | 5/20 | 0.54 |
| ▸ | CTSL | P07711 | 5/20 | 0.54 |
| ▸ | CTSB | P07858 | 3/20 | 0.54 |
| ▸ | CASP1 | P29466 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.49 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.49 |
| ▸ | KYNU | Q16719 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL7414295 | 0.93 | CAPN1 (0.60) | CAPN1CAPN2CTSKCTSSCTSL | |
| SCHEMBL25715928 | 0.89 | PPARA (0.56) | CAPN1CAPN2CTSKCTSSCTSL | |
| SCHEMBL22137672 | 0.87 | CAPN1 (0.56) | CAPN1CAPN2CTSKCTSSCTSL | |
| SCHEMBL1091870 | 0.85 | ITGB3 (0.54) | CTSKCTSSCTSLCTSBCASP1 | |
| SCHEMBL1091875 | 0.85 | ITGB3 (0.54) | CTSKCTSSCTSLCTSBCASP1 | |
| SCHEMBL31524154 | 0.84 | CTSS (0.54) | CTSKCTSSCTSLCTSBCASP1 | |
| SCHEMBL19227539 | 0.83 | ALDH1A1 (0.57) | CTSKCTSSCTSLCTSBCASP1 | |
| SCHEMBL4280674 | 0.83 | CASP1 (0.67) | CASP1 | |
| SCHEMBL26195471 | 0.83 | CTSK (0.64) | CTSKCTSSCTSLCTSBALDH1A1 | |
| SCHEMBL4280669 | 0.83 | CASP1 (0.67) | CASP1 |
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-1993013066-A1 | CYCLIC AMIDES OF 3-AMINO-2-HYDROXY-CARBOXYLIC ACIDS AS HIV-PROTEASE INHIBITORS | SYNTEX (U.S.A.) INC. (US) | 1993-07-08 | — | — | WO | disclosed |