Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1LG2 | Q9BQ51 | 2/20 | 0.41 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7466400 | 0.80 | HTT (0.35) | ALDH1A1 | |
| SCHEMBL8649190 | 0.79 | GRIN1 (0.34) | PDCD1LG2CD274ALDH1A1 | |
| SCHEMBL8489890 | 0.76 | GRIN1 (0.37) | ALDH1A1 | |
| SCHEMBL8524293 | 0.75 | HRH4 (0.30) | — | |
| SCHEMBL7470510 | 0.74 | RAB9A (0.46) | ALDH1A1 | |
| SCHEMBL8490082 | 0.74 | GRIN1 (0.37) | ALDH1A1 | |
| SCHEMBL8490077 | 0.74 | GLP1R (0.31) | — | |
| SCHEMBL7473579 | 0.74 | GLP1R (0.35) | — | |
| SCHEMBL7472397 | 0.74 | GRIN1 (0.35) | ALDH1A1 | |
| SCHEMBL7467566 | 0.73 | GRIN1 (0.39) | ALDH1A1 |
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-5852016-A | Quinoxaline derivatives useful in therapy | PFIZER INC. (US) | 1998-12-22 | — | — | US | disclosed |