Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.33 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.33 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Styrene SCHEMBL4656530 | 0.89 | ALDH1A1 (0.58) | ALDH1A1CYP3A4MEN1KMT2ATSHR | |
| SCHEMBL11866829 | 0.85 | CYP3A4 (0.49) | ALDH1A1CYP3A4CYP2C9CYP2C19MAPT | |
| SCHEMBL24299463 | 0.80 | CYP3A4 (0.37) | ALDH1A1CYP3A4CYP2C9CYP2C19MAPT | |
| SCHEMBL11800299 | 0.78 | CYP3A4 (0.53) | CYP3A4CYP2C9CYP2C19MAPTTDP1 | |
| SCHEMBL11800306 | 0.78 | CYP3A4 (0.53) | CYP3A4CYP2C9CYP2C19MAPTTDP1 | |
| SCHEMBL18714866 | 0.76 | APP (0.52) | ALDH1A1CYP3A4CYP2C9CYP2C19MAPT | |
| SCHEMBL9967765 | 0.76 | APP (0.48) | ALDH1A1CYP3A4CYP2C9CYP2C19MAPT | |
| SCHEMBL2869906 | 0.76 | NFE2L2 (0.54) | MEN1KMT2ATRPA1LMNA | |
| SCHEMBL14465008 | 0.76 | AHR (0.48) | CYP1A2 | |
| SCHEMBL9967711 | 0.76 | AHR (0.48) | CYP1A2 |
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-116789885-A | White inkjet ink composition comprising hollow composite particles | 内蒙古显鸿科技股份有限公司 | 2023-09-22 | — | — | CN | disclosed |