Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | HCAR2 | Q8TDS4 | 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 | |
|---|---|---|---|---|
| SCHEMBL7086432 | 0.90 | GABRP (0.31) | — | |
| Hydrochloric Acid SCHEMBL18320900 | 0.89 | LMNA (0.33) | — | |
| SCHEMBL15787046 | 0.76 | — | — | |
| SCHEMBL7451061 | 0.75 | CDC7 (0.30) | — | |
| SCHEMBL28869947 | 0.72 | HSD17B10 (0.35) | L3MBTL1ALDH1A1 | |
| SCHEMBL6661057 | 0.70 | — | — | |
| SCHEMBL11880678 | 0.63 | OR51E2 (0.32) | — | |
| SCHEMBL5963593 | 0.63 | — | — | |
| SCHEMBL419917 | 0.61 | CCR2 (0.31) | — | |
| SCHEMBL8874669 | 0.61 | GABRR1 (0.39) | — |
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-107428690-A | Mutation IDH1 inhibitor available for treating cancer | 美国政府健康及人类服务部 | 2017-12-01 | — | — | CN | disclosed |