Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 2/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.30 |
| ▸ | NR1H2 | P55055 | 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 | |
|---|---|---|---|---|
| SCHEMBL28776242 | 0.80 | DRD3 (0.30) | — | |
| SCHEMBL28721922 | 0.74 | NR1H2 (0.48) | NR1H2 | |
| SCHEMBL28721924 | 0.74 | NR1H2 (0.48) | NR1H2 | |
| SCHEMBL28938073 | 0.74 | NR1H2 (0.48) | NR1H2 | |
| SCHEMBL28458593 | 0.72 | TSHR (0.33) | — | |
| SCHEMBL28876754 | 0.71 | NR1H2 (0.30) | NR1H2 | |
| SCHEMBL18701954 | 0.71 | SPR (0.39) | CNR2 | |
| SCHEMBL4698579 | 0.70 | CHRM2 (0.36) | — | |
| SCHEMBL4399555 | 0.70 | CHRM2 (0.36) | — | |
| SCHEMBL28721334 | 0.69 | CHRM1 (0.38) | — |
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-110088098-A | Quinazolinones PARP-1 inhibitor and preparation method thereof, pharmaceutical composition and purposes | 中国医学科学院药物研究所 | 2019-08-02 | — | — | CN | disclosed |