Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.74 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.74 |
| ▸ | KARS1 | Q15046 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | APEX1 | P27695 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | AR | P10275 | 2/20 | 0.43 |
| ▸ | MDM2 | Q00987 | 8/20 | 0.33 |
| ▸ | SOD1 | P00441 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 6/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | RXRA | P19793 | 1/20 | 0.31 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.31 |
| ▸ | CDK2 | P24941 | 1/20 | 0.31 |
| ▸ | RXRB | P28702 | 1/20 | 0.31 |
| ▸ | RXRG | P48443 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL15588776 | 0.85 | ESR1 (1.00) | ESR1ESR2KARS1POLBAPEX1 | |
| SCHEMBL31674431 | 0.85 | ESR1 (1.00) | ESR1ESR2KARS1POLBAPEX1 | |
| SCHEMBL25381713 | 0.80 | ESR1 (0.66) | ESR1ESR2KARS1POLBAPEX1 | |
| SCHEMBL29403700 | 0.68 | ESR1 (0.48) | ESR1ESR2KARS1CYP3A4MAPT | |
| SCHEMBL3706021 | 0.67 | CYP3A4 (0.69) | ESR1ESR2KARS1CYP3A4MAPT | |
| SCHEMBL15388986 | 0.66 | CYP3A4 (0.64) | ESR1ESR2KARS1CYP3A4MAPT | |
| SCHEMBL15388987 | 0.66 | CYP3A4 (0.64) | ESR1ESR2KARS1CYP3A4MAPT | |
| SCHEMBL28617784 | 0.65 | KARS1 (1.00) | ESR1ESR2KARS1POLBAPEX1 | |
| SCHEMBL3212768 | 0.65 | CYP3A4 (0.78) | ESR1ESR2KARS1POLBAPEX1 | |
| SCHEMBL15588782 | 0.65 | KARS1 (1.00) | ESR1ESR2KARS1POLBAPEX1 |
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-117740961-A | Compound analysis method of liquorice and liquorice probiotics fermentation preparation | 北京中医药大学 | 2024-03-22 | — | — | CN | disclosed |