Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.63 |
| ▸ | BLM | P54132 | 2/20 | 0.63 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.63 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.51 |
| ▸ | BCHE | P06276 | 2/20 | 0.50 |
| ▸ | TYR | P14679 | 2/20 | 0.50 |
| ▸ | ACHE | P22303 | 2/20 | 0.50 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.50 |
| ▸ | FOLH1 | Q04609 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.48 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.48 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.48 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.48 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL298386 | 0.88 | TSHR (0.67) | TSHRBLMNPSR1GAACYP3A4 | |
| SCHEMBL27524318 | 0.88 | ACHE (0.55) | TSHRBLMNPSR1CYP3A4ACHE | |
| SCHEMBL29085942 | 0.87 | LMNA (0.54) | TSHRBLMNPSR1GAACYP3A4 | |
| SCHEMBL3182348 | 0.86 | TSHR (0.65) | TSHRBLMNPSR1GAACYP3A4 | |
| Alcohol SCHEMBL17179872 | 0.85 | TSHR (0.63) | TSHRBLMNPSR1GAACYP3A4 | |
| SCHEMBL17179835 | 0.84 | TSHR (0.61) | TSHRBLMNPSR1GAACYP3A4 | |
| SCHEMBL9250603 | 0.84 | BLM (0.61) | TSHRBLMNPSR1GAACYP3A4 | |
| SCHEMBL17179831 | 0.82 | TSHR (0.60) | TSHRBLMNPSR1GAACYP3A4 | |
| SCHEMBL20945422 | 0.82 | TSHR (0.60) | TSHRBLMNPSR1GAACYP3A4 | |
| Phenol SCHEMBL16868807 | 0.81 | TSHR (0.58) | TSHRBLMNPSR1GAACYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105523917-A | Preparation method for 3,5-dimethoxy-4-hydroxyphenylpropionic acid | TIANJIN HEOWNS BIOCHEMISTRY TECH CO LTD | 2016-04-27 | — | — | CN | disclosed |
| CN-105523917-A | Preparation method for 3,5-dimethoxy-4-hydroxyphenylpropionic acid | TIANJIN HEOWNS BIOCHEMISTRY TECH CO LTD | 2016-04-27 | — | — | CN | disclosed |
| CN-105523917-A | Preparation method for 3,5-dimethoxy-4-hydroxyphenylpropionic acid | TIANJIN HEOWNS BIOCHEMISTRY TECH CO LTD | 2016-04-27 | — | — | CN | disclosed |