Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | TDO2 | P48775 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | AXL | P30530 | 1/20 | 0.32 |
| ▸ | KIF11 | P52732 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | MPL | P40238 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27801187 | 0.84 | P2RX7 (0.51) | P2RX7IDO1TDO2HSD11B1SLC22A12 | |
| SCHEMBL22366928 | 0.81 | HSD11B1 (0.36) | P2RX7IDO1TDO2HSD11B1SLC22A12 | |
| SCHEMBL31258568 | 0.79 | CES2 (0.41) | IDO1TDO2CES1CES2ALDH1A1 | |
| SCHEMBL5826145 | 0.79 | P2RX7 (0.38) | P2RX7IDO1TDO2HSD11B1SLC22A12 | |
| SCHEMBL4547921 | 0.79 | P2RX7 (0.42) | P2RX7IDO1TDO2HSD11B1SLC22A12 | |
| SCHEMBL26620983 | 0.76 | P2RX7 (0.40) | P2RX7IDO1TDO2HSD11B1SLC22A12 | |
| SCHEMBL14120994 | 0.76 | P2RX7 (0.40) | P2RX7IDO1TDO2HSD11B1SLC22A12 | |
| SCHEMBL19697140 | 0.75 | HSD11B1 (0.39) | P2RX7HSD11B1SLC6A2SLC6A4PTGS2 | |
| SCHEMBL19405291 | 0.73 | CTSS (0.40) | P2RX7HSD11B1SLC22A12SLC6A2SLC6A4 | |
| SCHEMBL4083407 | 0.72 | P2RX7 (0.45) | P2RX7IDO1TDO2CES1CA2 |
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-112041296-B | Aminoacetamides containing benzooxy alicyclic structures and uses thereof | 上海璃道医药科技有限公司 | 2023-12-29 | — | — | CN | disclosed |