Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.34 |
| ▸ | NOS3 | P29474 | 2/20 | 0.33 |
| ▸ | NOS1 | P29475 | 2/20 | 0.33 |
| ▸ | NOS2 | P35228 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | SOAT1 | P35610 | 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 | |
|---|---|---|---|---|
| SCHEMBL28899513 | 0.97 | ALDH1A1 (0.38) | ALDH1A1TP53TDP1CYP3A4MEN1 | |
| SCHEMBL28899512 | 0.87 | ALDH1A1 (0.43) | ALDH1A1TP53TDP1CYP3A4MEN1 | |
| SCHEMBL28899511 | 0.87 | ALDH1A1 (0.43) | ALDH1A1TP53TDP1CYP3A4MEN1 | |
| SCHEMBL28899514 | 0.84 | GABRA1 (0.39) | ALDH1A1CYP3A4MEN1KMT2AMAPK1 | |
| SCHEMBL28899517 | 0.82 | ALDH1A1 (0.40) | ALDH1A1TP53TDP1CYP3A4MEN1 | |
| SCHEMBL28899508 | 0.82 | GABRA1 (0.35) | ALDH1A1CYP3A4NOS3NOS1NOS2 | |
| SCHEMBL7937857 | 0.79 | GABRA1 (0.45) | ALDH1A1CYP3A4KMT2AHTTNOS3 | |
| SCHEMBL11138433 | 0.71 | ALDH1A1 (0.41) | ALDH1A1TP53TDP1CYP3A4MEN1 | |
| SCHEMBL6893053 | 0.70 | GABRA1 (0.40) | ALDH1A1CYP3A4HTTNOS3NOS1 | |
| SCHEMBL28899510 | 0.69 | ALDH1A1 (0.34) | ALDH1A1TP53TDP1CYP3A4KMT2A |
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-115244127-A | Acrylic rubber composition and rubber crosslinked product | 日本瑞翁株式会社 | 2022-10-25 | — | — | CN | disclosed |