Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | CASP7 | P55210 | 1/20 | 0.33 |
| ▸ | CASP6 | P55212 | 1/20 | 0.33 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.33 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.32 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24465279 | 0.84 | ALDH1A1 (0.42) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL24452799 | 0.83 | ALDH1A1 (0.39) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL24452902 | 0.81 | MCL1 (0.36) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL24453054 | 0.79 | ALDH1A1 (0.54) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL24465297 | 0.79 | ALDH1A1 (0.41) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL24465372 | 0.79 | ALDH1A1 (0.39) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL24452903 | 0.77 | ALDH1A1 (0.49) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL729501 | 0.76 | ALDH1A1 (0.65) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL24452530 | 0.75 | MCL1 (0.45) | ALDH1A1GLAPKMGAALMNA | |
| SCHEMBL24465281 | 0.75 | HTT (0.40) | ALDH1A1TSHRPKMMCL1PIN1 |
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-4006921-A2 | BIO-ELECTRODE COMPOSITION, BIO-ELECTRODE, METHOD FOR MANUFACTURING BIO-ELECTRODE, AND REACTION COMPOSITE | Shin-Etsu Chemical Co., Ltd. (JP) | 2022-06-01 | — | — | EP | disclosed |