Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 2/20 | 0.52 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 4/20 | 0.45 |
| ▸ | CA2 | P00918 | 4/20 | 0.45 |
| ▸ | CA12 | O43570 | 3/20 | 0.45 |
| ▸ | CA9 | Q16790 | 3/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.45 |
| ▸ | CA7 | P43166 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | XDH | P47989 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | SETD7 | Q8WTS6 | 1/20 | 0.44 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.44 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.44 |
| ▸ | PTPRC | P08575 | 2/20 | 0.43 |
| ▸ | PTPRF | P10586 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | CDC25B | P30305 | 1/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28270387 | 0.93 | EGFR (0.52) | EGFRPTGS2SLC2A1CA1CA2 | |
| SCHEMBL4707492 | 0.91 | SLC6A4 (0.48) | EGFRPTGS2CA1CA2CA12 | |
| SCHEMBL16938242 | 0.90 | CA1 (0.50) | EGFRCA1CA2CA12CA9 | |
| SCHEMBL6925340 | 0.88 | MAP4K4 (0.45) | EGFRPTGS2MAPTXDH | |
| SCHEMBL5937242 | 0.88 | NOTUM (0.47) | EGFRPTPN1 | |
| SCHEMBL7021441 | 0.84 | PTPN1 (0.54) | EGFRCA1CA2CA12CA9 | |
| SCHEMBL28268795 | 0.84 | KDM4E (0.49) | EGFRPTGS2CA1CA2CA12 | |
| SCHEMBL16937869 | 0.83 | CA12 (0.44) | SLC2A1CA1CA2CA12CA9 | |
| SCHEMBL1028046 | 0.82 | CA1 (0.52) | CA1CA2CA12CA9CA14 | |
| SCHEMBL29559628 | 0.82 | CA1 (0.52) | CA1CA2CA12CA9CA14 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117399071-A | Chiral bifunctional catalyst UiO-67-Pro-Ru and preparation method and application thereof | 东南大学 | 2024-01-16 | — | — | CN | claimed |
| CN-114479081-B | Phosphonic acid functionalized polybenzimidazole and preparation method and application thereof | 华南理工大学 | 2023-04-21 | — | — | CN | claimed |
| CN-114479081-A | Phosphonic acid functionalized polybenzimidazole and preparation method and application thereof | 华南理工大学 | 2022-05-13 | — | — | CN | claimed |
| CN-117399071-A | Chiral bifunctional catalyst UiO-67-Pro-Ru and preparation method and application thereof | 东南大学 | 2024-01-16 | — | — | CN | disclosed |
| CN-114479081-B | Phosphonic acid functionalized polybenzimidazole and preparation method and application thereof | 华南理工大学 | 2023-04-21 | — | — | CN | disclosed |
| CN-114479081-A | Phosphonic acid functionalized polybenzimidazole and preparation method and application thereof | 华南理工大学 | 2022-05-13 | — | — | CN | disclosed |