Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 4/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | ACE | P12821 | 2/20 | 0.36 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CAPN1 | P07384 | 4/20 | 0.35 |
| ▸ | CTSB | P07858 | 1/20 | 0.35 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.34 |
| ▸ | FKBP1A | P62942 | 3/20 | 0.34 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7069676 | 0.87 | ADAMTS5 (0.43) | MMP9ALDH1A1ADAMTS5KEAP1 | |
| SCHEMBL7069725 | 0.78 | LMNA (0.40) | ALDH1A1ADAMTS5KEAP1 | |
| SCHEMBL7320271 | 0.75 | ITGB3 (0.37) | MMP9ALDH1A1 | |
| SCHEMBL7070854 | 0.73 | MMP2 (0.56) | MMP2MMP9ALDH1A1 | |
| SCHEMBL7069746 | 0.73 | ADAMTS5 (0.46) | MMP9ACEACE2ALDH1A1ADAMTS5 | |
| SCHEMBL7385520 | 0.72 | TAS2R14 (0.41) | ADAMTS5KEAP1 | |
| SCHEMBL3856501 | 0.68 | TAS2R14 (0.35) | ALDH1A1ADAMTS5KEAP1 | |
| SCHEMBL7069483 | 0.68 | NPSR1 (0.41) | MMP9ALDH1A1ADAMTS5KEAP1 | |
| SCHEMBL7421577 | 0.66 | MMP9 (0.37) | MMP9ALDH1A1ADAMTS5 | |
| SCHEMBL3850724 | 0.66 | P2RX7 (0.33) | ALDH1A1 |
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-1001975-A1 | BENZYL COMPOUNDS WHICH INHIBIT LEUKOCYTE ADHESION MEDIATED BY VLA-4 | Elan Pharmaceuticals, Inc. (US) | 2000-05-24 | — | — | EP | disclosed |
| WO-1999006436-A1 | BENZYL COMPOUNDS WHICH INHIBIT LEUKOCYTE ADHESION MEDIATED BY VLA-4 | ELAN PHARMACEUTICALS, INC. (US) | 1999-02-11 | — | — | WO | disclosed |