Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | BLM | P54132 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | PARP1 | P09874 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | CES1 | P23141 | 3/20 | 0.42 |
| ▸ | CES2 | O00748 | 2/20 | 0.42 |
| ▸ | DAO | P14920 | 1/20 | 0.42 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 2/20 | 0.40 |
| ▸ | AKT1 | P31749 | 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 | |
|---|---|---|---|---|
| SCHEMBL524788 | 0.84 | MAPT (0.56) | MAPTTDP1CYP2C19TSHRCYP3A4 | |
| SCHEMBL30584613 | 0.79 | CES2 (0.46) | MAPTTSHRALDH1A1CES1CES2 | |
| Trimethylammonium SCHEMBL11762680 | 0.77 | EGFR (0.52) | MAPTTDP1CYP2C19TSHRCYP3A4 | |
| SCHEMBL22206291 | 0.77 | ALDH1A1 (0.58) | MAPTTDP1CYP2C19TSHRCYP3A4 | |
| Dimethylamine SCHEMBL27722244 | 0.77 | MAPT (0.48) | MAPTTDP1CYP2C19TSHRCYP3A4 | |
| Acrylic Acid SCHEMBL28102225 | 0.75 | AKT1 (0.52) | MAPTTDP1CYP2C19TSHRCYP3A4 | |
| SCHEMBL22080015 | 0.74 | BLM (0.48) | MAPTTDP1CYP2C19TSHRCYP3A4 | |
| Trifluoroacetic Acid SCHEMBL5892926 | 0.74 | CES1 (0.50) | MAPTTDP1CYP2C19TSHRCYP3A4 | |
| SCHEMBL2455360 | 0.72 | SMN1; SMN2 (0.52) | MAPTL3MBTL1EGFRLMNAKDM4E | |
| SCHEMBL1959867 | 0.72 | CES1 (0.50) | MAPTTDP1CYP2C19TSHRCYP3A4 |
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-116685583-A | Pyrimidine compounds, compositions and pharmaceutical uses thereof | 缆图药品公司 | 2023-09-01 | — | — | CN | disclosed |