Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.47 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | CA7 | P43166 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9101908 | 0.83 | NR1H2 (0.51) | NR1H2NR1H3CA12CA1CA2 | |
| SCHEMBL12942245 | 0.80 | NR1H2 (0.45) | NR1H2NR1H3CA12CA1CA2 | |
| SCHEMBL377395 | 0.79 | MAPK1 (0.53) | CA12CA1CA2CA7CA9 | |
| SCHEMBL8203344 | 0.78 | NR1H2 (0.53) | NR1H2NR1H3CA12CA1CA2 | |
| SCHEMBL19678522 | 0.78 | ALDH1A1 (0.47) | NR1H2NR1H3CA12CA1CA2 | |
| Hydrochloric Acid SCHEMBL11407766 | 0.77 | MAPK1 (0.52) | CA12CA1CA2CA7CA9 | |
| SCHEMBL25475531 | 0.77 | ALDH1A1 (0.50) | NR1H2NR1H3CA12CA1CA2 | |
| SCHEMBL14665187 | 0.76 | NR1H2 (0.41) | NR1H2NR1H3CA12CA1CA2 | |
| SCHEMBL8934411 | 0.76 | TSHR (0.44) | NR1H2NR1H3CA12CA1CA2 | |
| SCHEMBL8812648 | 0.76 | NR1H2 (0.41) | NR1H2NR1H3CA12CA1CA2 |
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-111943863-B | Preparation method of iodixanol | 江苏悦兴医药技术有限公司 | 2022-10-21 | — | — | CN | disclosed |