Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.83 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | IDO1 | P14902 | 1/20 | 0.52 |
| ▸ | AGXT | P21549 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 4/20 | 0.48 |
| ▸ | CA2 | P00918 | 4/20 | 0.48 |
| ▸ | CA9 | Q16790 | 4/20 | 0.48 |
| ▸ | CA7 | P43166 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | DAO | P14920 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL27380 | 0.91 | TSHR (1.00) | TSHRALDH1A1IDO1AGXTCA1 | |
| Benzene SCHEMBL27997624 | 0.91 | TSHR (1.00) | TSHRALDH1A1IDO1AGXTCA1 | |
| SCHEMBL5311581 | 0.91 | TSHR (1.00) | TSHRALDH1A1IDO1AGXTCA1 | |
| Methoxymethane SCHEMBL27428029 | 0.89 | TSHR (0.83) | TSHRALDH1A1IDO1AGXTCA1 | |
| Propane SCHEMBL11584021 | 0.89 | TSHR (0.83) | TSHRALDH1A1IDO1AGXTCA1 | |
| SCHEMBL10317949 | 0.88 | TSHR (0.94) | TSHRALDH1A1IDO1AGXTCA1 | |
| Calcium SCHEMBL2864550 | 0.88 | TSHR (0.94) | TSHRALDH1A1IDO1AGXTCA1 | |
| SCHEMBL1009266 | 0.88 | TSHR (0.94) | TSHRALDH1A1IDO1AGXTCA1 | |
| Potassium SCHEMBL586337 | 0.88 | TSHR (0.94) | TSHRALDH1A1IDO1AGXTCA1 | |
| Methane SCHEMBL11192510 | 0.88 | TSHR (0.94) | TSHRALDH1A1IDO1AGXTCA1 |
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-109912683-A | Cytotoxin molecule, conjugate, preparation method and application thereof | 杭州多禧生物科技有限公司 | 2019-06-21 | — | — | CN | disclosed |