Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFB | P00751 | 1/20 | 0.32 |
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.31 |
| ▸ | 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 | |
|---|---|---|---|---|
| SCHEMBL16610540 | 0.89 | MAOA (0.35) | AADATALDH1A1 | |
| SCHEMBL28003803 | 0.80 | DRD2 (0.36) | — | |
| SCHEMBL28004247 | 0.76 | KDR (0.34) | — | |
| SCHEMBL16610660 | 0.76 | CYP19A1 (0.36) | ALDH1A1 | |
| SCHEMBL28003810 | 0.72 | OPRK1 (0.34) | CFBALDH1A1 | |
| SCHEMBL28003808 | 0.68 | DRD2 (0.38) | CFBAADAT | |
| SCHEMBL16610534 | 0.67 | ALDH1A1 (0.39) | ALDH1A1 | |
| SCHEMBL16610681 | 0.67 | ALDH1A1 (0.39) | ALDH1A1 | |
| SCHEMBL28003814 | 0.66 | JAK2 (0.37) | CFB | |
| SCHEMBL16610752 | 0.66 | CYP19A1 (0.40) | — |
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-104470918-A | Aromatic heterocyclic derivative and pharmaceutical | NIPPON SHINYAKU CO LTD | 2015-03-25 | — | — | CN | disclosed |