Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA4 | P22748 | 1/20 | 0.32 |
| ▸ | CA6 | P23280 | 1/20 | 0.32 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.31 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.31 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.31 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.31 |
| ▸ | AHR | P35869 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL656173 | 1.00 | TDP1 (0.42) | TDP1APEX1AKR1B1CA1CA2 | |
| Water SCHEMBL2803385 | 0.97 | TDP1 (0.40) | TDP1APEX1AKR1B1CA1CA2 | |
| SCHEMBL31070426 | 0.92 | TDP1 (0.40) | TDP1APEX1AKR1B1CA1CA2 | |
| SCHEMBL1352856 | 0.84 | TDP1 (0.48) | TDP1APEX1AKR1B1CA1CA2 | |
| Ether SCHEMBL2803384 | 0.82 | TDP1 (0.35) | TDP1MAPTNPSR1 | |
| SCHEMBL29365907 | 0.74 | — | — | |
| SCHEMBL30208225 | 0.74 | TDP1 (0.40) | TDP1APEX1AKR1B1CA1CA2 | |
| SCHEMBL1352858 | 0.74 | — | — | |
| Water SCHEMBL28680324 | 0.74 | CA1 (0.31) | APEX1CA1CA2CA4CA6 | |
| SCHEMBL356679 | 0.73 | TDP1 (0.56) | TDP1APEX1AKR1B1CA1CA2 |
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-115561348-A | High-sensitivity detection device and method for 25 polybrominated diphenyl ethers in aquatic products | 上海市农业科学院 | 2023-01-03 | — | — | CN | disclosed |