Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 6/20 | 0.61 |
| ▸ | CA4 | P22748 | 5/20 | 0.61 |
| ▸ | CA5A | P35218 | 5/20 | 0.61 |
| ▸ | CA9 | Q16790 | 5/20 | 0.61 |
| ▸ | CA12 | O43570 | 4/20 | 0.61 |
| ▸ | CA1 | P00915 | 4/20 | 0.61 |
| ▸ | CA7 | P43166 | 4/20 | 0.61 |
| ▸ | CA5B | Q9Y2D0 | 4/20 | 0.61 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | SRC | P12931 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MMP2 | P08253 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 1/20 | 0.42 |
| ▸ | MMP8 | P22894 | 1/20 | 0.42 |
| ▸ | MMP14 | P50281 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL20819121 | 0.90 | CA2 (0.71) | CA2CA4CA5ACA9CA12 | |
| Benzene SCHEMBL28297820 | 0.86 | CA2 (0.66) | CA2CA4CA5ACA9CA12 | |
| SCHEMBL752987 | 0.86 | CA2 (0.66) | CA2CA4CA5ACA9CA12 | |
| SCHEMBL3963455 | 0.84 | CA2 (0.64) | CA2CA4CA5ACA9CA12 | |
| SCHEMBL9584229 | 0.84 | CA2 (0.64) | CA2CA4CA5ACA9CA12 | |
| SCHEMBL673830 | 0.84 | CA2 (0.64) | CA2CA4CA5ACA9CA12 | |
| SCHEMBL639056 | 0.84 | CA2 (0.64) | CA2CA4CA5ACA9CA12 | |
| SCHEMBL149682 | 0.84 | CA2 (0.64) | CA2CA4CA5ACA9CA12 | |
| SCHEMBL28825799 | 0.84 | CA2 (0.64) | CA2CA4CA5ACA9CA12 | |
| Hydrochloric Acid SCHEMBL5100853 | 0.84 | CA2 (0.64) | CA2CA4CA5ACA9CA12 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116425794-A | Aryl phosphonate compound and preparation method thereof | 烟台大学 | 2023-07-14 | — | — | CN | claimed |
| CN-116425794-A | Aryl phosphonate compound and preparation method thereof | 烟台大学 | 2023-07-14 | — | — | CN | disclosed |