Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CRHBP | P24387 | 1/20 | 0.42 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | APP | P05067 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29365322 | 0.98 | ALDH1A1 (0.50) | ALDH1A1TDP1ADRA2BPTGS1KDM4E | |
| SCHEMBL1629992 | 0.98 | ALDH1A1 (0.50) | ALDH1A1TDP1ADRA2BPTGS1KDM4E | |
| SCHEMBL28930064 | 0.95 | ALDH1A1 (0.48) | ALDH1A1TDP1ADRA2BPTGS1KDM4E | |
| SCHEMBL28665189 | 0.95 | ALDH1A1 (0.48) | ALDH1A1TDP1ADRA2BPTGS1KDM4E | |
| Hydrochloric Acid SCHEMBL28776334 | 0.95 | ALDH1A1 (0.48) | ALDH1A1TDP1ADRA2BPTGS1KDM4E | |
| SCHEMBL28598792 | 0.86 | ALDH1A1 (0.45) | ALDH1A1TDP1ADRA2BPTGS1KDM4E | |
| SCHEMBL27585529 | 0.80 | CD44 (0.43) | ALDH1A1TDP1ADRA2BPTGS1KDM4E | |
| SCHEMBL6678412 | 0.80 | ENPP2 (0.44) | ALDH1A1TDP1ADRA2BPTGS1MAPT | |
| SCHEMBL29706601 | 0.80 | ENPP2 (0.44) | ALDH1A1TDP1ADRA2BPTGS1MAPT | |
| SCHEMBL31356477 | 0.79 | ALDH1A1 (0.35) | ALDH1A1TDP1ADRA2BPTGS1KDM4E |
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-110041739-B | Oversized graphene aqueous slurry for efficient corrosion prevention and preparation method thereof | 砥创(苏州)新材料科技有限公司 | 2021-11-26 | — | — | CN | claimed |