Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 11/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | TACR1 | P25103 | 1/20 | 0.41 |
| ▸ | ACE2 | Q9BYF1 | 4/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.40 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.40 |
| ▸ | ITGAV | P06756 | 1/20 | 0.40 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.40 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MME | P08473 | 1/20 | 0.39 |
| ▸ | MMEL1 | Q495T6 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL697393 | 0.87 | P2RX7 (0.43) | ACECA1CA2SMN1; SMN2POLB | |
| SCHEMBL3718797 | 0.77 | ACE (0.51) | ACEACE2LMNALTA4H | |
| SCHEMBL697293 | 0.77 | P2RX7 (0.45) | ACE | |
| SCHEMBL3719499 | 0.76 | ACE (0.45) | ACESMN1; SMN2ALDH1A1 | |
| SCHEMBL7380769 | 0.71 | ALDH1A1 (0.51) | ACEACE2SMN1; SMN2ITGB3ITGB1 | |
| SCHEMBL3727147 | 0.69 | MMP8 (0.58) | SMN1; SMN2POLBALDH1A1LMNA | |
| SCHEMBL3723026 | 0.69 | CTSS (0.47) | ACECA2SMN1; SMN2ITGB3ITGB1 | |
| SCHEMBL7381633 | 0.68 | ALDH1A1 (0.54) | ACEACE2SMN1; SMN2ITGB3ITGB1 | |
| SCHEMBL7381072 | 0.67 | LTA4H (0.47) | ACEACE2SMN1; SMN2ITGB3ITGB1 | |
| SCHEMBL10799355 | 0.67 | ACE (0.49) | ACEACE2NPSR1ALDH1A1LMNA |
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 |