Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | ACE | P12821 | 1/20 | 0.45 |
| ▸ | LTA4H | P09960 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | PPARA | Q07869 | 1/20 | 0.42 |
| ▸ | FOLH1 | Q04609 | 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 | |
|---|---|---|---|---|
| SCHEMBL5418068 | 0.84 | CYP1A2 (0.55) | CYP2C19ACECYP1A2PPARGPPARA | |
| SCHEMBL7076099 | 0.81 | GRIK1 (0.59) | CYP2C19ACECYP1A2FOLH1 | |
| SCHEMBL7053102 | 0.81 | CPA3 (0.63) | CYP2C19CYP1A2FOLH1 | |
| SCHEMBL8500821 | 0.81 | CYP1A2 (0.53) | CYP2C19ACECYP1A2PPARGPPARA | |
| SCHEMBL8500824 | 0.81 | CYP1A2 (0.53) | CYP2C19ACECYP1A2PPARGPPARA | |
| SCHEMBL9107156 | 0.81 | CNR2 (0.47) | PPARGFOLH1 | |
| SCHEMBL7434987 | 0.79 | CYP1A2 (0.66) | CYP1A2FOLH1 | |
| SCHEMBL27682962 | 0.79 | CYP1A2 (0.50) | CYP2C19ACECYP1A2PPARGPPARA | |
| SCHEMBL9226840 | 0.78 | ACE (0.50) | CYP2C19ACECYP1A2PPARGPPARA | |
| SCHEMBL5428457 | 0.77 | MME (0.48) | CYP2C19ACECYP1A2PPARGPPARA |
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-5470834-A | Metalloproteinase enzyme inhibitors for arthritis, rheumatism and cancers | FLORIDA STATE UNIVERSITY (US) | 1995-11-28 | — | — | US | disclosed |