Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH2 | P25021 | 1/20 | 0.50 |
| ▸ | HRH1 | P35367 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | MAOB | P27338 | 1/20 | 0.49 |
| ▸ | HSD17B3 | P37058 | 6/20 | 0.47 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.42 |
| ▸ | PLA2G5 | P39877 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9264219 | 1.00 | HRH2 (0.50) | HRH2HRH1MEN1ALDH1A1MAPT | |
| Hydrochloric Acid SCHEMBL27505767 | 0.90 | MAOB (0.47) | HRH2HRH1MEN1ALDH1A1MAPT | |
| SCHEMBL11728742 | 0.86 | MAOB (0.54) | KMT2AMAOBHSD17B3 | |
| SCHEMBL3826858 | 0.83 | MAOB (0.46) | HRH2HRH1MAPTMAOB | |
| SCHEMBL7814459 | 0.79 | MAOB (0.54) | MEN1ALDH1A1MAPTKMT2AMAOB | |
| SCHEMBL14757597 | 0.74 | MAOB (0.57) | KMT2AMAOB | |
| SCHEMBL5655626 | 0.74 | NPC1 (0.62) | MAPTHTTKMT2A | |
| SCHEMBL28703131 | 0.74 | NPC1 (0.48) | MEN1ALDH1A1MAPTKMT2AMAOB | |
| SCHEMBL28719788 | 0.73 | MAOB (0.53) | KMT2AMAOB | |
| SCHEMBL28713425 | 0.73 | NPC1 (0.61) | ALDH1A1MAPTMAOBFFAR1 |
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-114213307-A | Preparation method of N-alkyl substituted pyrrolidone compound | 河南农业大学 | 2022-03-22 | — | — | CN | disclosed |