Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MME | P08473 | 13/20 | 0.56 |
| ▸ | ACE | P12821 | 11/20 | 0.56 |
| ▸ | CPA1 | P15085 | 9/20 | 0.56 |
| ▸ | ACE2 | Q9BYF1 | 9/20 | 0.56 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.45 |
| ▸ | FPR2 | P25090 | 1/20 | 0.44 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.42 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.42 |
| ▸ | ITGAV | P06756 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 1/20 | 0.42 |
| ▸ | MMP13 | P45452 | 1/20 | 0.42 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.42 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.42 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7514233 | 0.93 | MME (0.49) | MMEACECPA1ACE2CA2 | |
| SCHEMBL7916012 | 0.83 | MME (0.58) | MMEACECPA1ACE2CA2 | |
| SCHEMBL7453286 | 0.82 | PDE4D (0.55) | MMEACECPA1ACE2CA2 | |
| SCHEMBL7444546 | 0.79 | MMP13 (0.52) | MMEACECPA1ACE2CA2 | |
| SCHEMBL7447863 | 0.77 | MME (0.51) | MMEACECPA1ACE2CA2 | |
| SCHEMBL7447944 | 0.77 | MME (0.52) | MMEACECPA1ACE2CA2 | |
| SCHEMBL7452231 | 0.75 | MME (0.50) | MMEACECPA1ACE2CA2 | |
| SCHEMBL7446281 | 0.72 | FPR2 (0.45) | MMEACECPA1ACE2PDE4D | |
| SCHEMBL7447599 | 0.71 | CA2 (0.44) | MMECA2PDE4DITGB3ITGAV | |
| SCHEMBL6375346 | 0.69 | ITGA4 (0.46) | CA2FPR2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6221888-B1 | ANTIHISTAMINE, ANTIINFLAMMATORY AGENT, AUTOIMMUNE DISEASE, RHEUMATIC DISORDERS | MERCK & CO., INC. | 2001-04-24 | — | — | US | claimed |
| EP-0998282-A4 | SULFONAMIDES AS CELL ADHESION INHIBITORS | MERCK & CO INC (US) | 2000-08-30 | — | — | EP | claimed |
| EP-0998282-A1 | SULFONAMIDES AS CELL ADHESION INHIBITORS | Merck & Co., Inc. (a New Jersey corp.) (US) | 2000-05-10 | — | — | EP | claimed |
| WO-1998053818-A1 | SULFONAMIDES AS CELL ADHESION INHIBITORS | MERCK & CO., INC. (US) | 1998-12-03 | — | — | WO | claimed |