Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 2/20 | 0.59 |
| ▸ | MMP9 | P14780 | 2/20 | 0.59 |
| ▸ | FKBP1A | P62942 | 3/20 | 0.56 |
| ▸ | LMNA | P02545 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | GHSR | Q92847 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL17833176 | 1.00 | MMP2 (0.59) | MMP2MMP9FKBP1ALMNAMAPT | |
| SCHEMBL8718942 | 0.95 | LMNA (0.58) | MMP2MMP9FKBP1ALMNAMAPT | |
| SCHEMBL23519421 | 0.87 | ALDH1A1 (0.65) | MMP2MMP9FKBP1ALMNAMAPT | |
| SCHEMBL6997 | 0.87 | ALDH1A1 (0.65) | MMP2MMP9FKBP1ALMNAMAPT | |
| SCHEMBL6996 | 0.87 | ALDH1A1 (0.65) | MMP2MMP9FKBP1ALMNAMAPT | |
| Water SCHEMBL28790504 | 0.86 | ALDH1A1 (0.63) | MMP2MMP9FKBP1ALMNAMAPT | |
| SCHEMBL15538805 | 0.85 | GHSR (0.60) | MMP2MMP9FKBP1AALDH1A1SMN1; SMN2 | |
| SCHEMBL28864063 | 0.85 | LMNA (0.63) | LMNAMAPTALDH1A1SMN1; SMN2GAA | |
| SCHEMBL10433913 | 0.85 | GAA (0.63) | FKBP1AMAPTALDH1A1GAA | |
| SCHEMBL19563393 | 0.85 | PLAU (0.50) | MMP2MMP9LMNAALDH1A1GAA |
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 4 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 | claimed |
| WO-2010121918-A1 | PROLINE DERIVATIVES AS CATHEPSIN INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-10-28 | — | — | WO | claimed |
| WO-2012152983-A1 | PHENYL- SULFONYL DERIVATIVES AS MEDIATORS OF TRPA1 RECEPTOR ACTIVITY FOR THE TREATMENT OF PAIN | ORION CORPORATION (FI) | 2012-11-15 | — | — | WO | disclosed |
| EP-2520566-A1 | New Pharmaceutical Compounds | Orion Corporation (FI) | 2012-11-07 | — | — | EP | disclosed |