Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 1/20 | 0.49 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.45 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.45 |
| ▸ | PPARG | P37231 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.45 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | ROS1 | P08922 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28894690 | 1.00 | AHR (0.49) | AHRRXFP1CYP3A4CYP2C9KMT2A | |
| SCHEMBL30085643 | 1.00 | AHR (0.49) | AHRRXFP1CYP3A4CYP2C9KMT2A | |
| SCHEMBL25458371 | 1.00 | AHR (0.49) | AHRRXFP1CYP3A4CYP2C9KMT2A | |
| SCHEMBL28894687 | 1.00 | AHR (0.49) | AHRRXFP1CYP3A4CYP2C9KMT2A | |
| SCHEMBL30085860 | 0.89 | DYRK1A (0.48) | AHRRXFP1CYP3A4CYP2C9KMT2A | |
| SCHEMBL28894803 | 0.89 | DYRK1A (0.48) | AHRRXFP1CYP3A4CYP2C9KMT2A | |
| SCHEMBL28894678 | 0.89 | DYRK1A (0.48) | AHRRXFP1CYP3A4CYP2C9KMT2A | |
| SCHEMBL28895062 | 0.89 | DYRK1A (0.48) | AHRRXFP1CYP3A4CYP2C9KMT2A | |
| SCHEMBL30085457 | 0.89 | DYRK1A (0.48) | AHRRXFP1CYP3A4CYP2C9KMT2A | |
| SCHEMBL30085767 | 0.89 | DYRK1A (0.46) | AHRRXFP1CYP3A4CYP2C9KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-115397818-A | Aminopyrimidine derivatives and their use as modulators of arene receptors | 东亚ST株式会社 | 2022-11-25 | — | — | CN | claimed |
| CN-115397818-A | Aminopyrimidine derivatives and their use as modulators of arene receptors | 东亚ST株式会社 | 2022-11-25 | — | — | CN | disclosed |