Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.48 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.39 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.37 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | PPARD | Q03181 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | ARG2 | P78540 | 1/20 | 0.34 |
| ▸ | NAALAD2 | Q9Y3Q0 | 2/20 | 0.34 |
| ▸ | FOLH1 | Q04609 | 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 | |
|---|---|---|---|---|
| SCHEMBL2160963 | 1.00 | CYP1A2 (0.54) | CYP1A2GABRR1LTA4HBLMACE2 | |
| SCHEMBL2160966 | 1.00 | CYP1A2 (0.54) | CYP1A2GABRR1LTA4HBLMACE2 | |
| SCHEMBL13384365 | 1.00 | CYP1A2 (0.54) | CYP1A2GABRR1LTA4HBLMACE2 | |
| Hydrochloric Acid SCHEMBL28546455 | 0.98 | CYP1A2 (0.52) | CYP1A2GABRR1LTA4HBLMACE2 | |
| SCHEMBL5407252 | 0.88 | GABRR1 (0.54) | CYP1A2GABRR1LTA4HBLMACE2 | |
| SCHEMBL5407249 | 0.88 | GABRR1 (0.54) | CYP1A2GABRR1LTA4HBLMACE2 | |
| SCHEMBL7253734 | 0.87 | CYP1A2 (0.50) | CYP1A2GABRR1LTA4HBLMACE2 | |
| SCHEMBL7253732 | 0.87 | CYP1A2 (0.50) | CYP1A2GABRR1LTA4HBLMACE2 | |
| SCHEMBL21595291 | 0.85 | LTA4H (0.52) | CYP1A2GABRR1LTA4HBLMACE2 | |
| SCHEMBL21595289 | 0.85 | LTA4H (0.52) | CYP1A2GABRR1LTA4HBLMACE2 |
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-5811462-A | (BICYCLO(2.2.1)HEPT-5'-EN-2'-YL-CARBONYL)AMINO-3-HYDROXY DERIVATIVES | MERCK & CO., INC. (US) | 1998-09-22 | — | — | US | disclosed |