Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 7/20 | 0.55 |
| ▸ | CTSK | P43235 | 3/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.50 |
| ▸ | ECE1 | P42892 | 1/20 | 0.49 |
| ▸ | MME | P08473 | 5/20 | 0.48 |
| ▸ | ACE | P12821 | 4/20 | 0.45 |
| ▸ | CPA1 | P15085 | 4/20 | 0.45 |
| ▸ | ACE2 | Q9BYF1 | 4/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | ITGB1 | P05556 | 4/20 | 0.41 |
| ▸ | ITGA4 | P13612 | 4/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7988924 | 0.90 | CTSC (0.56) | CTSCCTSKKCNH2MMEACE | |
| SCHEMBL7971253 | 0.86 | CTSC (0.58) | CTSCCTSKKCNH2MMEACE | |
| SCHEMBL6367397 | 0.83 | CTSC (0.56) | CTSCCTSKKCNH2MMEACE | |
| SCHEMBL6367393 | 0.83 | CTSC (0.56) | CTSCCTSKKCNH2MMEACE | |
| SCHEMBL22127884 | 0.83 | CTSC (0.56) | CTSCCTSKKCNH2MMEACE | |
| SCHEMBL601567 | 0.83 | CTSC (0.68) | CTSCCTSKKCNH2MMEACE | |
| SCHEMBL21808154 | 0.83 | CTSC (0.68) | CTSCCTSKKCNH2MMEACE | |
| SCHEMBL28122660 | 0.83 | CTSC (0.68) | CTSCCTSKKCNH2MMEACE | |
| SCHEMBL31026629 | 0.83 | CTSC (0.68) | CTSCCTSKKCNH2MMEACE | |
| SCHEMBL28122659 | 0.83 | CTSC (0.68) | CTSCCTSKKCNH2MMEACE |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6291511-B1 | Biarylalkanoic acids as cell adhesion inhibitors | MERCK & CO., INC. | 2001-09-18 | — | — | US | disclosed |