Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7198979 | 0.70 | CYP19A1 (0.38) | — | |
| SCHEMBL2064252 | 0.70 | ALDH1A1 (0.40) | ALDH1A1 | |
| SCHEMBL10394276 | 0.69 | CYP19A1 (0.39) | — | |
| SCHEMBL5240397 | 0.68 | — | — | |
| SCHEMBL28047878 | 0.68 | — | — | |
| SCHEMBL9542237 | 0.64 | — | — | |
| SCHEMBL27882958 | 0.62 | — | — | |
| SCHEMBL7640440 | 0.61 | CYP1A2 (0.31) | CYP1A2 | |
| SCHEMBL7640444 | 0.61 | CYP1A2 (0.31) | CYP1A2 | |
| SCHEMBL7370478 | 0.60 | DRD3 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1098407-A | Inhibitors of HIV protease as the treatment AIDS | LILLY CO ELI (US) | 1995-02-08 | — | — | CN | disclosed |