Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.68 |
| ▸ | TSHR | P16473 | 2/20 | 0.68 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.68 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.56 |
| ▸ | CES2 | O00748 | 1/20 | 0.52 |
| ▸ | CES1 | P23141 | 1/20 | 0.52 |
| ▸ | IDO1 | P14902 | 2/20 | 0.50 |
| ▸ | AGXT | P21549 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.46 |
| ▸ | GSK3B | P49841 | 1/20 | 0.46 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1374017 | 1.00 | ALDH1A1 (0.68) | ALDH1A1TSHRTRPA1TAAR1CES2 | |
| Biphenyl SCHEMBL27732862 | 1.00 | ALDH1A1 (0.68) | ALDH1A1TSHRTRPA1TAAR1CES2 | |
| SCHEMBL71123 | 1.00 | ALDH1A1 (0.68) | ALDH1A1TSHRTRPA1TAAR1CES2 | |
| Hydrochloric Acid SCHEMBL28118078 | 0.97 | ALDH1A1 (0.65) | ALDH1A1TSHRTRPA1TAAR1CES2 | |
| SCHEMBL5498364 | 0.95 | ALDH1A1 (0.62) | ALDH1A1TSHRTRPA1TAAR1CES2 | |
| Biphenyl SCHEMBL7524026 | 0.92 | TSHR (0.82) | ALDH1A1TSHRTRPA1TAAR1CES2 | |
| SCHEMBL679626 | 0.88 | TSHR (0.56) | ALDH1A1TSHRTRPA1TAAR1CES2 | |
| SCHEMBL9609757 | 0.88 | TSHR (0.56) | ALDH1A1TSHRTRPA1TAAR1CES2 | |
| SCHEMBL9023806 | 0.87 | ALDH1A1 (0.59) | ALDH1A1TSHRTRPA1TAAR1CES2 | |
| Acetic Acid SCHEMBL28491683 | 0.87 | CES2 (0.57) | ALDH1A1TSHRTRPA1TAAR1CES2 |
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-105837514-B | The preparation method of Fimasartan impurity of the drug | 北京睿创康泰医药研究院有限公司 | 2018-09-18 | — | — | CN | disclosed |
| CN-105837514-A | Fimasartan drug impurity preparation method | 北京睿创康泰医药研究院有限公司 | 2016-08-10 | — | — | CN | disclosed |