Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | MGAM | O43451 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | SI | P14410 | 1/20 | 0.43 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.43 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28293945 | 0.97 | ALDH1A1 (0.56) | ALDH1A1TSHRMAPTLMNAHSD17B10 | |
| SCHEMBL79588 | 0.97 | ALDH1A1 (0.56) | ALDH1A1TSHRMAPTLMNAHSD17B10 | |
| SCHEMBL28099320 | 0.94 | ALDH1A1 (0.54) | ALDH1A1TSHRMAPTLMNAHSD17B10 | |
| SCHEMBL13269637 | 0.92 | ALDH1A1 (0.56) | ALDH1A1TSHRMAPTLMNAHSD17B10 | |
| SCHEMBL19679991 | 0.90 | THRB (0.54) | ALDH1A1TSHRMAPTLMNAHSD17B10 | |
| Acetic Acid SCHEMBL28826956 | 0.90 | ALDH1A1 (0.55) | ALDH1A1TSHRMAPTLMNAHSD17B10 | |
| Benzene SCHEMBL27784210 | 0.90 | ALDH1A1 (0.66) | ALDH1A1TSHRMAPTLMNAHSD17B10 | |
| SCHEMBL6657389 | 0.87 | ALDH1A1 (0.48) | ALDH1A1TSHRMAPTLMNAHSD17B10 | |
| SCHEMBL15536700 | 0.85 | ALDH1A1 (0.47) | ALDH1A1TSHRMAPTLMNAHSD17B10 | |
| SCHEMBL14886410 | 0.85 | TSHR (0.53) | ALDH1A1TSHRMAPTLMNAHSD17B10 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109651198-A | A kind of synthetic method of dimethylamino diethyl methylenemalonate | 常州沃腾化工科技有限公司 | 2019-04-19 | — | — | CN | disclosed |