Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | AKR1B10 | O60218 | 3/20 | 0.43 |
| ▸ | AKR1B1 | P15121 | 3/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.41 |
| ▸ | CTSK | P43235 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| Propionic Acid SCHEMBL28726098 | 0.81 | HCAR2 (0.49) | HCAR2TDP1AKR1B10AKR1B1ESR1 | |
| SCHEMBL873497 | 0.81 | HCAR2 (0.54) | HCAR2TDP1AKR1B10AKR1B1ESR1 | |
| SCHEMBL872898 | 0.81 | HCAR2 (0.54) | HCAR2TDP1AKR1B10AKR1B1ESR1 | |
| SCHEMBL872900 | 0.81 | HCAR2 (0.54) | HCAR2TDP1AKR1B10AKR1B1ESR1 | |
| SCHEMBL28363851 | 0.80 | HCAR2 (0.50) | HCAR2TDP1AKR1B10AKR1B1ESR1 | |
| SCHEMBL6490850 | 0.79 | HCAR2 (0.47) | HCAR2TDP1AKR1B10AKR1B1ESR1 | |
| Phenethyl Propionate SCHEMBL4653082 | 0.79 | TDP1 (0.59) | HCAR2TDP1AKR1B10AKR1B1ESR1 | |
| Phenethyl Propionate SCHEMBL114088 | 0.78 | TDP1 (0.63) | HCAR2TDP1AKR1B10AKR1B1ESR1 | |
| SCHEMBL3292422 | 0.78 | AKR1B10 (0.53) | HCAR2TDP1AKR1B10AKR1B1ESR1 | |
| SCHEMBL28186332 | 0.77 | HCAR2 (0.50) | HCAR2TDP1AKR1B10AKR1B1ESR1 |
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-113278210-A | Rubber-plastic alloy for modified asphalt mixture and preparation method thereof | 山东高速集团有限公司创新研究院 | 2021-08-20 | — | — | CN | disclosed |