Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 2/20 | 0.37 |
| ▸ | NOS1 | P29475 | 2/20 | 0.37 |
| ▸ | NOS2 | P35228 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL19398073 | 0.61 | — | — | |
| SCHEMBL18828488 | 0.58 | — | — | |
| SCHEMBL910154 | 0.58 | — | — | |
| SCHEMBL911284 | 0.58 | — | — | |
| SCHEMBL20000771 | 0.57 | DRD2 (0.33) | — | |
| SCHEMBL10492330 | 0.56 | FYN (0.35) | NOS3NOS1NOS2 | |
| Hydrogen Sulfide SCHEMBL5678855 | 0.56 | — | — | |
| SCHEMBL11017052 | 0.55 | NOS1 (0.31) | NOS1NOS2 | |
| SCHEMBL16411367 | 0.55 | CA1 (0.38) | NOS1NOS2 | |
| SCHEMBL25822469 | 0.55 | NOS3 (0.33) | NOS3NOS1NOS2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2854948-B1 | METAL-BASED THIOPHENE PHOTODYNAMIC COMPOUNDS AND THEIR USE | MCFARLAND SHERRI ANN (CA) | 2019-09-25 | — | — | EP | disclosed |