Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15611822 | 1.00 | CA1 (0.33) | CA1CA2CA9ALDH1A1TSHR | |
| SCHEMBL28555438 | 1.00 | CA1 (0.33) | CA1CA2CA9ALDH1A1TSHR | |
| SCHEMBL26441527 | 0.79 | — | — | |
| SCHEMBL10314778 | 0.79 | — | — | |
| SCHEMBL16821017 | 0.79 | LMNA (0.36) | ALDH1A1 | |
| SCHEMBL16821014 | 0.79 | LMNA (0.36) | ALDH1A1 | |
| SCHEMBL16821062 | 0.79 | LMNA (0.36) | ALDH1A1 | |
| SCHEMBL10314776 | 0.79 | — | — | |
| SCHEMBL15786358 | 0.78 | CA1 (0.31) | CA1CA2CA9 | |
| SCHEMBL7145096 | 0.76 | CA1 (0.32) | CA1CA2CA9ALDH1A1TSHR |
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-109776479-B | Preparation method of medical intermediate | 绍兴文理学院 | 2021-05-04 | — | — | CN | claimed |
| CN-109776479-B | Preparation method of medical intermediate | 绍兴文理学院 | 2021-05-04 | — | — | CN | disclosed |