Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLK4 | Q9HAZ1 | 8/20 | 0.64 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | PDE5A | O76074 | 3/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.52 |
| ▸ | USP2 | O75604 | 2/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL30085882 | 1.00 | CLK4 (0.64) | CLK4DYRK1ACYP3A4CYP2C9ALDH1A1 | |
| SCHEMBL30085785 | 0.92 | ALDH1A1 (0.62) | CLK4DYRK1ACYP3A4CYP2C9ALDH1A1 | |
| SCHEMBL28959741 | 0.92 | ALDH1A1 (0.62) | CLK4DYRK1ACYP3A4CYP2C9ALDH1A1 | |
| SCHEMBL28895256 | 0.84 | CYP3A4 (0.57) | CLK4DYRK1ACYP3A4CYP2C9ALDH1A1 | |
| SCHEMBL30085796 | 0.84 | CYP3A4 (0.57) | CLK4DYRK1ACYP3A4CYP2C9ALDH1A1 | |
| SCHEMBL28894839 | 0.83 | CYP3A4 (0.59) | CLK4DYRK1ACYP3A4CYP2C9ALDH1A1 | |
| SCHEMBL30085777 | 0.83 | CYP3A4 (0.59) | CLK4DYRK1ACYP3A4CYP2C9ALDH1A1 | |
| SCHEMBL28895149 | 0.82 | CYP3A4 (0.55) | CLK4DYRK1ACYP3A4CYP2C9ALDH1A1 | |
| SCHEMBL28894899 | 0.82 | DYRK1A (0.53) | CLK4DYRK1ACYP3A4CYP2C9ALDH1A1 | |
| SCHEMBL30085872 | 0.82 | CYP3A4 (0.55) | CLK4DYRK1ACYP3A4CYP2C9ALDH1A1 |
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-115397818-A | Aminopyrimidine derivatives and their use as modulators of arene receptors | 东亚ST株式会社 | 2022-11-25 | — | — | CN | disclosed |