Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.48 |
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.43 |
| ▸ | NQO2 | P16083 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | MGLL | Q99685 | 2/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CASP6 | P55212 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29414927 | 0.93 | HSD17B10 (0.46) | ALDH1A1HSD17B10HIF1ACYP1B1TRPM4 | |
| SCHEMBL24958 | 0.93 | HSD17B10 (0.46) | ALDH1A1HSD17B10HIF1ACYP1B1TRPM4 | |
| Benzene SCHEMBL5134896 | 0.91 | ALDH1A1 (0.50) | ALDH1A1HSD17B10HIF1ACYP1B1TRPM4 | |
| SCHEMBL29690415 | 0.86 | ALDH1A1 (0.56) | ALDH1A1HSD17B10HIF1ACYP1B1TRPM4 | |
| SCHEMBL2789059 | 0.86 | ALDH1A1 (0.56) | ALDH1A1HSD17B10HIF1ACYP1B1TRPM4 | |
| Magnesium Chloride Anhydrous SCHEMBL20694975 | 0.85 | L3MBTL1 (0.42) | ALDH1A1HSD17B10HIF1ACYP1B1TRPM4 | |
| SCHEMBL31338574 | 0.83 | TRPM4 (0.42) | ALDH1A1HSD17B10HIF1ACYP1B1TRPM4 | |
| SCHEMBL18253941 | 0.83 | TRPM4 (0.42) | ALDH1A1HSD17B10HIF1ACYP1B1TRPM4 | |
| SCHEMBL2859827 | 0.80 | TRPM4 (0.36) | ALDH1A1HSD17B10HIF1ACYP1B1TRPM4 | |
| SCHEMBL702357 | 0.79 | ENPP2 (0.45) | ALDH1A1HSD17B10CA1CA2CYP1A2 |
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-116283478-A | Organic compound and application thereof | 阜阳欣奕华材料科技有限公司 | 2023-06-23 | — | — | CN | disclosed |