Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | TYR | P14679 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.35 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | NT5E | P21589 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.31 |
| ▸ | F2R | P25116 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5031381 | 0.77 | SMN1; SMN2 (0.41) | SMN1; SMN2CA2ALDH1A1POLBTYR | |
| SCHEMBL3857163 | 0.77 | SMN1; SMN2 (0.41) | SMN1; SMN2CA2ALDH1A1POLBTYR | |
| SCHEMBL2524085 | 0.75 | NPC1 (0.56) | SMN1; SMN2CA2ALDH1A1POLBTYR | |
| SCHEMBL29492013 | 0.75 | NPC1 (0.56) | SMN1; SMN2CA2ALDH1A1POLBTYR | |
| SCHEMBL3179989 | 0.73 | KCNMA1 (0.51) | SMN1; SMN2ALDH1A1POLBNPC1RAB9A | |
| SCHEMBL5183293 | 0.71 | KCNMA1 (0.59) | ALDH1A1GRM2NT5EKCNMA1 | |
| Butylated Hydroxytoluene SCHEMBL27989431 | 0.70 | CA2 (0.69) | SMN1; SMN2CA2ALDH1A1POLBTYR | |
| SCHEMBL13245893 | 0.69 | SMN1; SMN2 (0.53) | SMN1; SMN2CA2ALDH1A1POLBTYR | |
| SCHEMBL4963816 | 0.68 | KCNMA1 (0.51) | SMN1; SMN2ALDH1A1POLBRAB9ACYP2C9 | |
| SCHEMBL2549440 | 0.66 | NPC1 (0.55) | SMN1; SMN2CA2ALDH1A1POLBTYR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020162592-A1 | POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIALS, OPTICAL MATERIAL AND USE OF SAME | 三井化学株式会社 | 2020-08-13 | — | — | WO | disclosed |