Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 5/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | GRM5 | P41594 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | GBA1 | P04062 | 1/20 | 0.35 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29380399 | 0.86 | BCHE (0.46) | GPR119KDM1AGRM5BCHEGRM1 | |
| SCHEMBL5560408 | 0.86 | BCHE (0.46) | GPR119KDM1AGRM5BCHEGRM1 | |
| Quinoline SCHEMBL28157604 | 0.83 | ALDH1A1 (0.44) | POLBALDH1A1MEN1KMT2A | |
| Indole SCHEMBL27827279 | 0.79 | TRPA1 (0.38) | KDM1AGRM5BCHEGRM1 | |
| SCHEMBL28984504 | 0.79 | POLB (0.43) | POLBGPR119KDM1AGRM5BCHE | |
| SCHEMBL852448 | 0.79 | POLB (0.43) | POLBGPR119KDM1AGRM5GRM1 | |
| Quinoline SCHEMBL28339254 | 0.76 | ALDH1A1 (0.50) | PDE10APOLBALDH1A1MEN1KMT2A | |
| SCHEMBL27739868 | 0.73 | BCHE (0.48) | GPR119KDM1AGRM5BCHEGRM1 | |
| Oxindole SCHEMBL28307962 | 0.72 | AHR (0.44) | KDM1AMEN1KMT2ABCHE | |
| SCHEMBL7112196 | 0.72 | KDM1A (0.37) | GPR119KDM1AGRM5MEN1KMT2A |
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-109761986-A | Three simultaneously ring analog derivative inhibitor, preparation method and applications | 上海翰森生物医药科技有限公司 | 2019-05-17 | — | — | CN | disclosed |