Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.41 |
| ▸ | HMGCR | P04035 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.34 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 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 | |
|---|---|---|---|---|
| SCHEMBL35674 | 0.92 | ALDH1A1 (0.56) | ALDH1A1CYP2C19CYP3A4CYP2C9MEN1 | |
| Hydrochloric Acid SCHEMBL7158460 | 0.90 | ALDH1A1 (0.54) | ALDH1A1CYP2C19CYP3A4CYP2C9MEN1 | |
| SCHEMBL9246722 | 0.90 | ALDH1A1 (0.54) | ALDH1A1CYP2C19CYP3A4CYP2C9MEN1 | |
| Dimethylamine SCHEMBL9133373 | 0.87 | ALDH1A1 (0.51) | ALDH1A1CYP2C19CYP3A4CYP2C9MEN1 | |
| Dimethylamine SCHEMBL9133610 | 0.87 | ALDH1A1 (0.51) | ALDH1A1CYP2C19CYP3A4CYP2C9MEN1 | |
| Acrylamide SCHEMBL11572641 | 0.84 | ALDH1A1 (0.45) | ALDH1A1CYP2C19CYP3A4CYP2C9MEN1 | |
| SCHEMBL17266437 | 0.79 | CYP2C19 (0.46) | ALDH1A1CYP2C19CYP3A4CYP2C9MEN1 | |
| Hydrochloric Acid SCHEMBL9133471 | 0.78 | ALDH1A1 (0.44) | ALDH1A1CYP2C19CYP3A4CYP2C9MEN1 | |
| Acrylamide SCHEMBL998819 | 0.78 | ALDH1A1 (0.50) | ALDH1A1CYP2C19CYP3A4CYP2C9MEN1 | |
| SCHEMBL31376272 | 0.78 | ALDH1A1 (0.46) | ALDH1A1CYP2C19CYP3A4CYP2C9MEN1 |
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-105199530-A | Super-hydrophilic polyacrylamide coating and preparation method thereof | CHINESE ACAD TECH INST PHYSICS | 2015-12-30 | — | — | CN | disclosed |