Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.53 |
| ▸ | NOS1 | P29475 | 1/20 | 0.53 |
| ▸ | NOS2 | P35228 | 1/20 | 0.53 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.50 |
| ▸ | SLC7A11 | Q9UPY5 | 1/20 | 0.50 |
| ▸ | SLC1A1 | P43005 | 5/20 | 0.46 |
| ▸ | SLC1A3 | P43003 | 3/20 | 0.46 |
| ▸ | SLC1A2 | P43004 | 3/20 | 0.46 |
| ▸ | GSR | P00390 | 2/20 | 0.46 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.46 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.46 |
| ▸ | GRM1 | Q13255 | 2/20 | 0.46 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.46 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.46 |
| ▸ | GRM8 | O00222 | 1/20 | 0.46 |
| ▸ | GRM6 | O15303 | 1/20 | 0.46 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.46 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | GRM5 | P41594 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL17434420 | 1.00 | NOS3 (0.53) | NOS3NOS1NOS2PTGS1SLC7A11 | |
| SCHEMBL8892097 | 1.00 | NOS3 (0.53) | NOS3NOS1NOS2PTGS1SLC7A11 | |
| Hydrochloric Acid SCHEMBL8893490 | 0.97 | NOS3 (0.52) | NOS3NOS1NOS2PTGS1SLC7A11 | |
| SCHEMBL25660439 | 0.88 | SLC7A5 (0.54) | NOS3NOS1NOS2PTGS1SLC7A11 | |
| SCHEMBL21526182 | 0.88 | SLC7A5 (0.54) | NOS3NOS1NOS2PTGS1SLC7A11 | |
| SCHEMBL31688874 | 0.88 | NOS3 (0.46) | NOS3NOS1NOS2PTGS1SLC7A11 | |
| SCHEMBL1287364 | 0.88 | SLC7A5 (0.54) | NOS3NOS1NOS2PTGS1SLC7A11 | |
| SCHEMBL18940917 | 0.87 | — | — | |
| SCHEMBL18940918 | 0.87 | — | — | |
| SCHEMBL23935435 | 0.86 | NOS3 (0.49) | NOS3NOS1NOS2PTGS1SLC7A11 |
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-5290465-A | Neopolyol derivatives and refrigerant compositions comprising them | ETHYL CORPORATION (US) | 1994-03-01 | — | — | US | disclosed |