Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA4 | P22748 | 1/20 | 0.56 |
| ▸ | LTA4H | P09960 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Anisole SCHEMBL29149580 | 0.87 | CA4 (0.74) | CA4LTA4HHPGDGLATDP1 | |
| Anisole SCHEMBL28687981 | 0.85 | CA4 (0.52) | CA4LTA4HHPGDGLATDP1 | |
| SCHEMBL5887762 | 0.83 | CA4 (0.59) | CA4LTA4HHPGDTDP1TRPA1 | |
| Anisole SCHEMBL332163 | 0.83 | CA4 (0.74) | CA4LTA4HHPGDGLATDP1 | |
| SCHEMBL21220127 | 0.80 | TSHR (0.53) | LMNATSHRCYP1A2MAPTCES2 | |
| Anisole SCHEMBL28681552 | 0.80 | CA4 (0.56) | CA4LTA4HHPGDTRPA1LMNA | |
| SCHEMBL6681950 | 0.78 | CA1 (0.65) | CA4LTA4HTDP1MEN1KMT2A | |
| SCHEMBL154527 | 0.75 | — | — | |
| SCHEMBL2226770 | 0.75 | — | — | |
| Anisole SCHEMBL8472521 | 0.75 | CA4 (1.00) | CA4LTA4HTDP1TRPA1HTT |
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-113930790-A | Synthetic method of aryl selenide compound | 南昌大学 | 2022-01-14 | — | — | CN | disclosed |