Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.79 |
| ▸ | STS | P08842 | 1/20 | 0.59 |
| ▸ | CA1 | P00915 | 5/20 | 0.58 |
| ▸ | CA2 | P00918 | 5/20 | 0.58 |
| ▸ | CA9 | Q16790 | 5/20 | 0.58 |
| ▸ | CA12 | O43570 | 4/20 | 0.58 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.58 |
| ▸ | MAPT | P10636 | 5/20 | 0.56 |
| ▸ | RAB9A | P51151 | 4/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.56 |
| ▸ | CASP3 | P42574 | 1/20 | 0.56 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.56 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.56 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.56 |
| ▸ | CA5A | P35218 | 1/20 | 0.55 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| Methyl Benzoate SCHEMBL27911579 | 0.94 | TSHR (0.76) | TSHRSTSCA1CA2CA9 | |
| Methyl Benzoate SCHEMBL23044121 | 0.89 | TSHR (0.83) | TSHRSTSCA1CA2CA9 | |
| Methyl Benzoate SCHEMBL28211382 | 0.89 | TSHR (0.83) | TSHRSTSCA1CA2CA9 | |
| Methyl Benzoate SCHEMBL27839065 | 0.89 | TSHR (0.91) | TSHRCA1CA2CA9CA12 | |
| Methyl Benzoate SCHEMBL28945661 | 0.89 | TSHR (1.00) | TSHRCA1CA2CA9CA12 | |
| Methyl Benzoate SCHEMBL1332323 | 0.89 | TSHR (1.00) | TSHRCA1CA2CA9CA12 | |
| Methyl Benzoate SCHEMBL1867855 | 0.89 | TSHR (1.00) | TSHRCA1CA2CA9CA12 | |
| Methyl Benzoate SCHEMBL28537345 | 0.89 | TSHR (1.00) | TSHRCA1CA2CA9CA12 | |
| Methyl Benzoate SCHEMBL29831725 | 0.89 | TSHR (1.00) | TSHRCA1CA2CA9CA12 | |
| Methyl Benzoate SCHEMBL29039896 | 0.89 | TSHR (1.00) | TSHRCA1CA2CA9CA12 |
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-106353450-A | Carbon monoxide detection reagent | 魏忠 | 2017-01-25 | — | — | CN | disclosed |