Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.43 |
| ▸ | CASP3 | P42574 | 9/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | MMP8 | P22894 | 1/20 | 0.41 |
| ▸ | CTSD | P07339 | 1/20 | 0.40 |
| ▸ | MME | P08473 | 2/20 | 0.40 |
| ▸ | ACE | P12821 | 2/20 | 0.40 |
| ▸ | CPA1 | P15085 | 1/20 | 0.40 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 6/20 | 0.40 |
| ▸ | CASP7 | P55210 | 6/20 | 0.40 |
| ▸ | CASP6 | P55212 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7348676 | 0.92 | POLB (0.52) | ALDH1A1POLBUSP2MAPTHPGD | |
| SCHEMBL7303797 | 0.88 | ALDH1A1 (0.49) | ALDH1A1POLBUSP2MAPTHPGD | |
| SCHEMBL7303784 | 0.88 | ALDH1A1 (0.49) | ALDH1A1POLBUSP2MAPTHPGD | |
| SCHEMBL7307336 | 0.87 | PSMB5 (0.47) | ALDH1A1PTPN1CASP3MMP2MMP9 | |
| SCHEMBL7301641 | 0.85 | ALDH1A1 (0.48) | ALDH1A1POLBUSP2MAPTHPGD | |
| SCHEMBL7301631 | 0.85 | ALDH1A1 (0.48) | ALDH1A1POLBUSP2MAPTHPGD | |
| SCHEMBL7311213 | 0.85 | ALDH1A1 (0.49) | ALDH1A1POLBUSP2MAPTHPGD | |
| SCHEMBL7311200 | 0.85 | ALDH1A1 (0.49) | ALDH1A1POLBUSP2MAPTHPGD | |
| SCHEMBL7438433 | 0.85 | CTSK (0.50) | CASP3CASP1 | |
| SCHEMBL7444208 | 0.85 | ALDH1A1 (0.46) | ALDH1A1POLBUSP2MAPTHPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0525420-B1 | Pseudopeptides and dipeptides characterised by a substituted methyl ketone moiety at the C-terminus as thiol protease inhibitors | MITSUBISHI CHEM CORP (JP) | 1999-05-12 | — | — | EP | disclosed |
| US-5834508-A | PROTEASE ENZYME INHIBITORS; MUSCLE DISORDERS | MITSUBISHI CHEMICAL CORPORATION (JP) | 1998-11-10 | — | — | US | disclosed |
| EP-0525420-A1 | Pseudopeptides and dipeptides characterised by a substituted methyl ketone moiety at the C-terminus as thiol protease inhibitors | Mitsubishi Chemical Corporation (JP) | 1993-02-03 | — | — | EP | disclosed |