Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.39 |
| ▸ | CFTR | P13569 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.34 |
| ▸ | ERN1 | O75460 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29472208 | 0.79 | — | — | |
| SCHEMBL25495 | 0.79 | — | — | |
| Formic Acid Methyl Ester SCHEMBL28401158 | 0.78 | CYP3A4 (0.64) | TSHRALDH1A1TDP1ADRA2BPTGS1 | |
| Formaldehyde SCHEMBL6858464 | 0.77 | TSHR (0.83) | TSHRALDH1A1NR4A2CYP3A4SMN1; SMN2 | |
| SCHEMBL357039 | 0.77 | — | — | |
| Ammonia Solution, Strong SCHEMBL10464135 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL31384191 | 0.77 | TSHR (0.94) | TSHRALDH1A1TDP1NR4A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL4373214 | 0.77 | TSHR (0.94) | TSHRALDH1A1TDP1NR4A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL1819559 | 0.77 | — | — | |
| SCHEMBL28534574 | 0.77 | — | — |
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-108047069-A | A kind of preparation method of 2- amino -3- chloro benzoic ethers | 南通泰禾化工股份有限公司 | 2018-05-18 | — | — | CN | claimed |
| CN-108047069-A | A kind of preparation method of 2- amino -3- chloro benzoic ethers | 南通泰禾化工股份有限公司 | 2018-05-18 | — | — | CN | disclosed |