Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.61 |
| ▸ | LMNA | P02545 | 2/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.52 |
| ▸ | ACHE | P22303 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | HPN | P05981 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA5A | P35218 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11567135 | 0.98 | TSHR (0.59) | TSHRLMNAALDH1A1ACHETDP1 | |
| Perchlorate SCHEMBL5574429 | 0.94 | TSHR (0.55) | TSHRLMNAALDH1A1ACHETDP1 | |
| SCHEMBL10897060 | 0.93 | TSHR (0.53) | TSHRLMNAALDH1A1ACHETDP1 | |
| SCHEMBL2913743 | 0.80 | TSHR (0.61) | TSHRLMNAALDH1A1ACHETDP1 | |
| SCHEMBL20956863 | 0.79 | CYP19A1 (0.54) | TSHRLMNAALDH1A1TDP1ALOX15 | |
| Hydrochloric Acid SCHEMBL11290393 | 0.78 | TSHR (0.59) | TSHRLMNAALDH1A1ACHETDP1 | |
| Hydrochloric Acid SCHEMBL11290386 | 0.78 | TSHR (0.59) | TSHRLMNAALDH1A1ACHETDP1 | |
| Dinitrophenylene SCHEMBL8142652 | 0.78 | TSHR (0.90) | TSHRLMNAALDH1A1ACHETDP1 | |
| Dinitrophenylene SCHEMBL29291896 | 0.78 | TSHR (1.00) | TSHRLMNAALDH1A1ACHETDP1 | |
| Dinitrophenylene SCHEMBL36632 | 0.78 | TSHR (1.00) | TSHRLMNAALDH1A1ACHETDP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108530240-B | Method for aromatic amine trifluoromethoxylation reaction | 中南大学 | 2020-06-23 | — | — | CN | disclosed |
| CN-108530240-A | A kind of method of arylamine trifluoromethoxyization reaction | 中南大学 | 2018-09-14 | — | — | CN | disclosed |