Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.32 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Methacrylic Acid SCHEMBL8466985 | 0.90 | ALDH1A1 (0.37) | TDP1ALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL234712 | 0.89 | ALDH1A1 (0.39) | TDP1ALDH1A1CYP3A4CYP2C9CYP2C19 | |
| Ammonia Solution, Strong SCHEMBL28169209 | 0.88 | ALDH1A1 (0.38) | TDP1ALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL6419402 | 0.88 | ALDH1A1 (0.38) | TDP1ALDH1A1CYP3A4CYP2C9CYP2C19 | |
| Acrylic Acid SCHEMBL1123835 | 0.84 | ALDH1A1 (0.40) | TDP1ALDH1A1CYP3A4CYP2C9CYP2C19 | |
| Acrylic Acid SCHEMBL27647713 | 0.83 | ALDH1A1 (0.32) | ALDH1A1CYP3A4CYP2C9CYP2C19ZDHHC20 | |
| Acrylic Acid SCHEMBL27348963 | 0.82 | ALDH1A1 (0.35) | ALDH1A1CYP3A4CYP2C9CYP2C19ZDHHC20 | |
| SCHEMBL4457041 | 0.78 | ALDH1A1 (0.40) | TDP1ALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL9658496 | 0.78 | TSHR (0.55) | TDP1ALDH1A1CYP3A4ZDHHC20ZDHHC2 | |
| SCHEMBL29192529 | 0.76 | ZDHHC20 (0.40) | TDP1ALDH1A1CYP3A4CYP2C9CYP2C19 |
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-1922248-B | Porous materials and method of production thereof | UNILEVER PLC | 2011-06-15 | — | — | CN | disclosed |
| CN-1922248-A | Porous materials and method of production thereof | UNILEVER PLC (NL) | 2007-02-28 | — | — | CN | disclosed |