Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 2/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | DAO | P14920 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10245894 | 0.92 | NOS2 (0.45) | NOS2NOS3NOS1CYP2A6SSTR4 | |
| SCHEMBL28129202 | 0.89 | L3MBTL1 (0.39) | NOS2NOS3NOS1CYP2A6SSTR4 | |
| SCHEMBL28239556 | 0.85 | NOS3 (0.42) | NOS2NOS3NOS1CYP2A6ALDH1A1 | |
| SCHEMBL8582607 | 0.81 | L3MBTL1 (0.43) | NOS2NOS3NOS1CYP2A6SSTR4 | |
| Ammonia Solution, Strong SCHEMBL28841614 | 0.79 | L3MBTL1 (0.42) | NOS2NOS3NOS1CYP2A6SSTR4 | |
| SCHEMBL15856910 | 0.79 | L3MBTL1 (0.50) | NOS2NOS3NOS1CYP2A6SSTR4 | |
| Bromide SCHEMBL28285568 | 0.79 | L3MBTL1 (0.42) | NOS2NOS3NOS1CYP2A6SSTR4 | |
| Trifluoromethanesulfonic Acid SCHEMBL30399066 | 0.79 | SSTR4 (0.39) | SSTR4ALDH1A1SMN1; SMN2MAPTCYP2C19 | |
| SCHEMBL28119974 | 0.79 | L3MBTL1 (0.39) | NOS2NOS3NOS1CYP2A6SSTR4 | |
| SCHEMBL6839265 | 0.78 | TDP1 (0.49) | NOS2NOS3NOS1CYP2A6MEN1 |
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-113122380-B | Method for removing glycidyl ester by utilizing ionic liquid | 丰益(上海)生物技术研发中心有限公司 | 2023-09-22 | — | — | CN | disclosed |