Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.64 |
| ▸ | TSHR | P16473 | 5/20 | 0.64 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.64 |
| ▸ | GPR35 | Q9HC97 | 3/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.60 |
| ▸ | TP53 | P04637 | 1/20 | 0.60 |
| ▸ | HPGD | P15428 | 1/20 | 0.60 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.60 |
| ▸ | GAA | P10253 | 2/20 | 0.58 |
| ▸ | THRB | P10828 | 1/20 | 0.58 |
| ▸ | ERN1 | O75460 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | ACHE | P22303 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | GLA | P06280 | 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 | |
|---|---|---|---|---|
| SCHEMBL61129 | 0.98 | ALDH1A1 (0.67) | ALDH1A1TSHRTDP1GPR35CYP3A4 | |
| SCHEMBL28782982 | 0.88 | PDE10A (0.63) | ALDH1A1TSHRTDP1GPR35CYP3A4 | |
| SCHEMBL29431205 | 0.84 | ALDH1A1 (0.56) | ALDH1A1TSHRTDP1GPR35CYP3A4 | |
| SCHEMBL16701937 | 0.83 | HSD17B1 (0.51) | ALDH1A1TSHRTDP1GPR35CYP3A4 | |
| SCHEMBL27661134 | 0.82 | TSHR (0.54) | ALDH1A1TSHRTDP1GPR35CYP3A4 | |
| SCHEMBL61902 | 0.82 | ALDH1A1 (0.67) | ALDH1A1TSHRTDP1GPR35CYP3A4 | |
| 4-Nitrocatechol SCHEMBL28290085 | 0.81 | ALDH1A1 (0.67) | ALDH1A1TSHRTDP1GPR35TP53 | |
| Ammonia Solution, Strong SCHEMBL9388499 | 0.80 | ALDH1A1 (0.64) | ALDH1A1TSHRTDP1GPR35CYP3A4 | |
| SCHEMBL12932222 | 0.79 | TDP1 (0.48) | ALDH1A1TSHRTDP1GPR35CYP3A4 | |
| SCHEMBL16076897 | 0.79 | TSHR (0.56) | ALDH1A1TSHRTDP1THRBACHE |
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-109704897-B | Wastewater recycling method based on dimethyl sulfate | 安徽节源环保科技有限公司 | 2020-07-03 | — | — | CN | disclosed |
| CN-109704897-A | A kind of waste water recycling method based on dimethyl suflfate | 安徽节源环保科技有限公司 | 2019-05-03 | — | — | CN | disclosed |