Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | SMYD3 | Q9H7B4 | 3/20 | 0.38 |
| ▸ | NOS1 | P29475 | 2/20 | 0.34 |
| ▸ | NOS3 | P29474 | 1/20 | 0.34 |
| ▸ | NOS2 | P35228 | 1/20 | 0.34 |
| ▸ | KMO | O15229 | 1/20 | 0.32 |
| ▸ | NQO1 | P15559 | 1/20 | 0.32 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.32 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.32 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.32 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.32 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.31 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.31 |
| ▸ | KEAP1 | Q14145 | 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 | |
|---|---|---|---|---|
| SCHEMBL5040720 | 0.73 | SMYD3 (0.40) | CYP2A6SMYD3NOS1NOS3NOS2 | |
| SCHEMBL9996143 | 0.69 | MAOB (0.49) | CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL3360077 | 0.68 | DAO (0.46) | SMYD3CYP1A2 | |
| SCHEMBL1244189 | 0.68 | SMYD3 (0.54) | SMYD3 | |
| SCHEMBL21691074 | 0.68 | SMYD3 (0.30) | SMYD3 | |
| SCHEMBL2406831 | 0.67 | SMYD3 (0.53) | SMYD3NOS1NOS3NOS2 | |
| SCHEMBL31373781 | 0.67 | CYP2A6 (0.41) | CYP2A6NOS1NOS3NOS2KMO | |
| SCHEMBL29951448 | 0.66 | CYP2A6 (0.37) | CYP2A6GRIA1GRIA2GRIA3GRIA4 | |
| SCHEMBL1673129 | 0.64 | NOS1 (0.37) | SMYD3NOS1NOS3NOS2KMO | |
| SCHEMBL22397020 | 0.64 | CYP2A6 (0.52) | CYP2A6GRIA1GRIA2GRIA3GRIA4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |
| US-10886479-B2 | Photoelectric conversion element, optical sensor, imaging element, and compound | FUJIFILM CORPORATION (JP) | 2021-01-05 | — | — | US | disclosed |
| US-20200035933-A1 | PHOTOELECTRIC CONVERSION ELEMENT, OPTICAL SENSOR, IMAGING ELEMENT, AND COMPOUND | FUJIFILM CORPORATION (JP) | 2020-01-30 | — | — | US | disclosed |