Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABBR2 | O75899 | 4/20 | 0.61 |
| ▸ | GABBR1 | Q9UBS5 | 4/20 | 0.61 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | FNTA | P49354 | 6/20 | 0.47 |
| ▸ | FNTB | P49356 | 6/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2292396 | 1.00 | GABBR2 (0.61) | GABBR2GABBR1MAPTFNTAFNTB | |
| SCHEMBL2289954 | 0.89 | GABBR2 (0.58) | GABBR2GABBR1MAPTFNTAFNTB | |
| SCHEMBL28642990 | 0.89 | GABBR2 (0.47) | GABBR2GABBR1MAPTPOLBLMNA | |
| SCHEMBL7663044 | 0.87 | GABBR2 (0.56) | GABBR2GABBR1MAPTPOLB | |
| SCHEMBL27688433 | 0.86 | GABBR2 (0.54) | GABBR2GABBR1MAPT | |
| SCHEMBL3242852 | 0.86 | GABBR2 (0.54) | GABBR2GABBR1MAPT | |
| SCHEMBL4403980 | 0.86 | GABBR2 (0.54) | GABBR2GABBR1MAPT | |
| SCHEMBL15614666 | 0.85 | ALDH1A1 (0.54) | GABBR2GABBR1MAPTPOLBLMNA | |
| SCHEMBL184884 | 0.85 | ALDH1A1 (0.54) | GABBR2GABBR1MAPTPOLBLMNA | |
| SCHEMBL3872457 | 0.85 | ESR1 (0.59) | GABBR2GABBR1MAPTFNTAFNTB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110590552-B | Synthetic method of acetate compound | 青岛农业大学 | 2022-02-08 | — | — | CN | disclosed |
| CN-110590552-A | Synthetic method of acetate compound | 青岛农业大学 | 2019-12-20 | — | — | CN | disclosed |