Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.32 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16860017 | 0.79 | ESR1 (0.39) | ESR1ESR2NR1H2NR1H3TSHR | |
| SCHEMBL31425696 | 0.79 | ESR1 (0.39) | ESR1ESR2NR1H2NR1H3TSHR | |
| SCHEMBL7896320 | 0.79 | ESR1 (0.39) | ESR1ESR2NR1H2NR1H3TSHR | |
| SCHEMBL235043 | 0.76 | ESR1 (0.41) | ESR1ESR2NR1H2NR1H3TSHR | |
| SCHEMBL842862 | 0.72 | ESR1 (0.42) | ESR1ESR2NR1H2NR1H3TSHR | |
| SCHEMBL842024 | 0.72 | ESR1 (0.42) | ESR1ESR2NR1H2NR1H3TSHR | |
| SCHEMBL11852672 | 0.72 | TSHR (0.42) | ESR1ESR2TSHRMAPTLMNA | |
| SCHEMBL234050 | 0.72 | ESR1 (0.38) | ESR1ESR2NR1H2NR1H3MAPT | |
| SCHEMBL9804953 | 0.72 | ESR1 (0.34) | ESR1ESR2TSHR | |
| Toluene SCHEMBL29142414 | 0.70 | ACHE (0.61) | TSHRLMNAALOX12ACHE |
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-112467135-A | Silicon-carbon composite material, preparation method and lithium ion battery thereof | 珠海中科兆盈丰新材料科技有限公司 | 2021-03-09 | — | — | CN | claimed |
| CN-112467135-A | Silicon-carbon composite material, preparation method and lithium ion battery thereof | 珠海中科兆盈丰新材料科技有限公司 | 2021-03-09 | — | — | CN | disclosed |