Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | SLC18A2 | Q05940 | 2/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.30 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.30 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.30 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.30 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | DRD1 | P21728 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3890706 | 0.82 | TP53 (0.34) | TP53TDP1PTGS2HIF1ATSHR | |
| SCHEMBL28300659 | 0.81 | ALDH1A1 (0.38) | TDP1SLC18A2HIF1ATSHRALDH1A1 | |
| SCHEMBL28056016 | 0.78 | — | — | |
| SCHEMBL3235395 | 0.77 | CYP1A2 (0.50) | TDP1HIF1ACYP1A2CYP2D6 | |
| SCHEMBL8260418 | 0.77 | CYP1A2 (0.50) | TDP1HIF1ACYP1A2CYP2D6 | |
| SCHEMBL8256890 | 0.77 | CYP1A2 (0.50) | TDP1HIF1ACYP1A2CYP2D6 | |
| SCHEMBL14384675 | 0.77 | CYP1A2 (0.50) | TDP1HIF1ACYP1A2CYP2D6 | |
| SCHEMBL22774104 | 0.75 | TP53 (0.44) | TP53TDP1PTGS2HIF1ATSHR | |
| SCHEMBL28055963 | 0.75 | — | — | |
| SCHEMBL2058773 | 0.74 | ALDH1A1 (0.39) | TP53TDP1PTGS2HIF1ATSHR |
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-109844627-A | Aligning agent for liquid crystal, liquid crystal orientation film and liquid crystal cell | JSR株式会社 | 2019-06-04 | — | — | CN | disclosed |
| CN-109844629-A | LIQUID CRYSTAL ALIGNING AGENT, LIQUID CRYSTAL ALIGNMENT FILM, LIQUID CRYSTAL ELEMENT AND POLYMER | JSR株式会社 | 2019-06-04 | — | — | CN | disclosed |