Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 2/20 | 0.49 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.49 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.49 |
| ▸ | NOS1 | P29475 | 7/20 | 0.38 |
| ▸ | NOS3 | P29474 | 6/20 | 0.38 |
| ▸ | NOS2 | P35228 | 5/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL20173404 | 0.81 | CYP2C9 (0.49) | ADRA2AADRA2BADRA2CNOS1NOS3 | |
| SCHEMBL24227104 | 0.80 | NOS1 (0.37) | ADRA2AADRA2BADRA2CNOS1NOS3 | |
| SCHEMBL13083301 | 0.77 | ALDH1A1 (0.49) | ADRA2AADRA2BADRA2CNOS1NOS3 | |
| SCHEMBL12201279 | 0.71 | ESR1 (0.60) | ADRA2AADRA2BADRA2CESR1ESR2 | |
| SCHEMBL19123060 | 0.69 | ACHE (0.40) | ADRA2AADRA2BADRA2CESR1ESR2 | |
| SCHEMBL19199258 | 0.68 | ADRA2A (0.40) | ADRA2AADRA2BADRA2CNOS1NOS3 | |
| SCHEMBL11755276 | 0.67 | AAK1 (0.54) | — | |
| SCHEMBL11755817 | 0.67 | AAK1 (0.54) | — | |
| SCHEMBL11755809 | 0.67 | AAK1 (0.54) | — | |
| SCHEMBL11755285 | 0.67 | AAK1 (0.54) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-11236250-B2 | Switchable water-based paint or coating compositions | QUEEN'S UNIVERSITY AT KINGSTON (CA) | 2022-02-01 | — | — | US | disclosed |
| US-20180142117-A1 | SWITCHABLE WATER-BASED PAINT OR COATING COMPOSITIONS | GREENCENTRE CANADA (CA) | 2018-05-24 | — | — | US | disclosed |