Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.43 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.43 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.36 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL26920467 | 0.82 | CYP3A4 (0.54) | TAS1R3TAS1R1ABCB11CYP3A4ADRA2B | |
| SCHEMBL20465897 | 0.82 | CYP3A4 (0.54) | TAS1R3TAS1R1ABCB11CYP3A4ADRA2B | |
| SCHEMBL1889774 | 0.82 | CYP3A4 (0.54) | TAS1R3TAS1R1ABCB11CYP3A4ADRA2B | |
| SCHEMBL20465900 | 0.82 | CYP3A4 (0.54) | TAS1R3TAS1R1ABCB11CYP3A4ADRA2B | |
| SCHEMBL20465901 | 0.82 | CYP3A4 (0.54) | TAS1R3TAS1R1ABCB11CYP3A4ADRA2B | |
| SCHEMBL20465899 | 0.82 | CYP3A4 (0.54) | TAS1R3TAS1R1ABCB11CYP3A4ADRA2B | |
| SCHEMBL20465896 | 0.82 | CYP3A4 (0.54) | TAS1R3TAS1R1ABCB11CYP3A4ADRA2B | |
| SCHEMBL841978 | 0.81 | ESR2 (0.50) | ALDH1A1MAPTESR2NPC1RAB9A | |
| SCHEMBL4454647 | 0.78 | MAPT (0.53) | CTNNB1ALDH1A1PKMMAPTNPC1 | |
| SCHEMBL21112010 | 0.78 | TAS1R3 (0.45) | TAS1R3TAS1R1ABCB11CYP3A4ADRA2B |
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 |
|---|---|---|---|---|---|---|---|
| EP-3984456-B1 | BIO-ELECTRODE COMPOSITION, BIO-ELECTRODE, METHOD FOR MANUFACTURING BIO-ELECTRODE, POLYMER COMPOUND, AND COMPOSITE | SHINETSU CHEMICAL CO (JP) | 2023-08-23 | — | — | EP | disclosed |