Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.47 |
| ▸ | CA1 | P00915 | 3/20 | 0.47 |
| ▸ | CA2 | P00918 | 3/20 | 0.47 |
| ▸ | CA7 | P43166 | 3/20 | 0.47 |
| ▸ | CA9 | Q16790 | 3/20 | 0.47 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.47 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.47 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 5/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | ATM | Q13315 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | CASP7 | P55210 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10431622 | 0.87 | MAPT (0.42) | CA12CA1CA2CA7CA9 | |
| SCHEMBL28034085 | 0.85 | CA12 (0.40) | CA12CA1CA2CA7CA9 | |
| SCHEMBL3299851 | 0.82 | KDM4E (0.53) | CA1CA2CA9KDM4ELMNA | |
| SCHEMBL29169382 | 0.81 | PDGFRB (0.42) | CA12CA1CA2CA7CA9 | |
| SCHEMBL30833246 | 0.81 | PDGFRB (0.42) | CA12CA1CA2CA7CA9 | |
| SCHEMBL804379 | 0.79 | NR4A2 (0.50) | CA12CA1CA2CA7CA9 | |
| SCHEMBL17080159 | 0.79 | KDM4E (0.62) | CA12CA1CA2CA7CA9 | |
| SCHEMBL2879979 | 0.79 | GAA (0.45) | CA12CA1CA2CA7CA9 | |
| SCHEMBL4059914 | 0.79 | CYP46A1 (0.53) | CA12CA1CA2CA7CA9 | |
| SCHEMBL829753 | 0.78 | CA12 (0.54) | CA12CA1CA2CA7CA9 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114591512-B | Functionalized zirconium-based metal organic cage and preparation method and application thereof | 广州大学 | 2023-03-21 | — | — | CN | claimed |
| CN-114591512-A | Functionalized zirconium-based metal organic cage and preparation method and application thereof | 广州大学 | 2022-06-07 | — | — | CN | claimed |
| CN-114591512-B | Functionalized zirconium-based metal organic cage and preparation method and application thereof | 广州大学 | 2023-03-21 | — | — | CN | disclosed |
| CN-114591512-A | Functionalized zirconium-based metal organic cage and preparation method and application thereof | 广州大学 | 2022-06-07 | — | — | CN | disclosed |