Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | TDO2 | P48775 | 1/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.33 |
| ▸ | GBA1 | P04062 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | BCHE | P06276 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL29577028 | 0.88 | LTC4S (0.36) | GAAMAPTPYCR1L3MBTL1KDM4E | |
| SCHEMBL29576972 | 0.87 | GBA1 (0.36) | GAAMAPTGBA1L3MBTL1KDM4E | |
| SCHEMBL29576840 | 0.83 | GBA1 (0.39) | IDO1GAAMAPTPYCR1GBA1 | |
| SCHEMBL29577530 | 0.83 | IDO1 (0.36) | CTSLIDO1GRM2GBA1 | |
| SCHEMBL29577163 | 0.81 | ALDH1A1 (0.41) | MAPTPYCR1KDM4EALDH1A1TDP1 | |
| SCHEMBL29577153 | 0.81 | CTSL (0.35) | CTSLGAAMAPTL3MBTL1KDM4E | |
| SCHEMBL29576842 | 0.80 | KCNQ3 (0.34) | CTSLIDO1GAAMAPTGBA1 | |
| SCHEMBL29577209 | 0.80 | KCNQ3 (0.34) | CTSLGAAMAPTGBA1L3MBTL1 | |
| SCHEMBL29576560 | 0.80 | CYP2D6 (0.34) | GAAMAPTL3MBTL1KDM4EALDH1A1 | |
| SCHEMBL29576693 | 0.79 | ESR1 (0.34) | GAAMAPTL3MBTL1KDM4EALDH1A1 |
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-108558841-B | 4- (N, N-disubstituted) furan-2 (5H) -ketone derivative, preparation method and application thereof | 贵州大学 | 2022-04-12 | — | — | CN | claimed |