Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | NT5E | P21589 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 10/20 | 0.43 |
| ▸ | CA2 | P00918 | 10/20 | 0.43 |
| ▸ | CA12 | O43570 | 8/20 | 0.43 |
| ▸ | CA7 | P43166 | 8/20 | 0.43 |
| ▸ | CA13 | Q8N1Q1 | 8/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | DAPK1 | P53355 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NSD2 | O96028 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | APEX1 | P27695 | 1/20 | 0.37 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Biphenyl SCHEMBL5404337 | 0.83 | TSHR (0.44) | TSHRALDH1A1CA1CA2CA12 | |
| SCHEMBL7048111 | 0.82 | TSHR (0.67) | TSHRALDH1A1NT5ECA1CA2 | |
| Aniline SCHEMBL11772251 | 0.78 | TSHR (0.58) | TSHRALDH1A1NT5ECA1CA2 | |
| Aniline SCHEMBL676147 | 0.78 | TSHR (0.65) | TSHRALDH1A1NT5ECA1CA2 | |
| Aniline SCHEMBL167326 | 0.78 | TSHR (0.65) | TSHRALDH1A1NT5ECA1CA2 | |
| Aniline SCHEMBL167327 | 0.78 | TSHR (0.65) | TSHRALDH1A1NT5ECA1CA2 | |
| SCHEMBL36242 | 0.78 | CA2 (0.52) | TSHRCA1CA2CA12CA7 | |
| Phenethylamine SCHEMBL28996433 | 0.77 | TAAR1 (0.53) | TSHRALDH1A1CA1CA2CA12 | |
| Aniline SCHEMBL28037884 | 0.75 | TSHR (0.61) | TSHRALDH1A1NT5ECA1CA2 | |
| Aniline SCHEMBL5693986 | 0.75 | TSHR (0.61) | TSHRALDH1A1NT5ECA1CA2 |
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-114805298-B | Method for preparing thiolactide | 中国科学院长春应用化学研究所 | 2024-02-09 | — | — | CN | disclosed |