Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 6/20 | 0.83 |
| ▸ | CA2 | P00918 | 6/20 | 0.83 |
| ▸ | CA12 | O43570 | 1/20 | 0.83 |
| ▸ | CA7 | P43166 | 1/20 | 0.83 |
| ▸ | CA9 | Q16790 | 1/20 | 0.83 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.83 |
| ▸ | TSHR | P16473 | 1/20 | 0.72 |
| ▸ | RAB9A | P51151 | 4/20 | 0.61 |
| ▸ | MAPT | P10636 | 3/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.61 |
| ▸ | CASP3 | P42574 | 1/20 | 0.61 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.61 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.61 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.61 |
| ▸ | LMNA | P02545 | 2/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.61 |
| ▸ | GAA | P10253 | 1/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| Phenol SCHEMBL8167350 | 0.98 | CA1 (0.79) | CA1CA2CA12CA7CA9 | |
| Methyl Benzoate SCHEMBL9685679 | 0.94 | TSHR (0.83) | CA1CA2CA12CA7CA9 | |
| Biphenyl SCHEMBL27469149 | 0.92 | CA1 (0.77) | CA1CA2CA12CA7CA9 | |
| Methylparaben SCHEMBL4440 | 0.91 | CA1 (1.00) | CA1CA2CA12CA7CA9 | |
| Methylparaben SCHEMBL321534 | 0.91 | CA1 (1.00) | CA1CA2CA12CA7CA9 | |
| Methylparaben SCHEMBL28316533 | 0.91 | CA1 (0.69) | CA1CA2CA12CA7CA9 | |
| Methyl Benzoate SCHEMBL28393301 | 0.90 | CA1 (0.74) | CA1CA2CA12CA7CA9 | |
| Methylparaben SCHEMBL8030878 | 0.90 | CA1 (0.74) | CA1CA2CA12CA7CA9 | |
| Methylparaben SCHEMBL9480744 | 0.90 | CA1 (0.74) | CA1CA2CA12CA7CA9 | |
| Methylparaben SCHEMBL27361228 | 0.89 | CA1 (0.87) | CA1CA2CA12CA7CA9 |
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-114644555-A | Method for preparing nipagin ester from lignin | 天津科技大学 | 2022-06-21 | — | — | CN | disclosed |