Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.31 |
| ▸ | KIF11 | P52732 | 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 | |
|---|---|---|---|---|
| SCHEMBL7044050 | 0.87 | GABRA1 (0.43) | CA2GABRA1GABRB2ALDH1A1TSHR | |
| SCHEMBL2045383 | 0.82 | CA2 (0.40) | CA2GABRA1GABRB2ALDH1A1TSHR | |
| SCHEMBL726454 | 0.82 | CA2 (0.40) | CA2GABRA1GABRB2ALDH1A1TSHR | |
| SCHEMBL2050307 | 0.79 | CA2 (0.48) | CA2GABRA1GABRB2ALDH1A1TSHR | |
| SCHEMBL2047275 | 0.79 | CA2 (0.48) | CA2GABRA1GABRB2ALDH1A1TSHR | |
| SCHEMBL1028544 | 0.77 | ALDH1A1 (0.33) | CA2ALDH1A1TSHRTDP1 | |
| SCHEMBL28623994 | 0.72 | ALDH1A1 (0.42) | CA2GABRA1GABRB2ALDH1A1TDP1 | |
| SCHEMBL215708 | 0.72 | ALDH1A1 (0.42) | CA2GABRA1GABRB2ALDH1A1TDP1 | |
| SCHEMBL28614786 | 0.72 | ALDH1A1 (0.39) | CA2GABRA1GABRB2ALDH1A1TSHR | |
| SCHEMBL4468064 | 0.72 | ALDH1A1 (0.39) | CA2GABRA1GABRB2ALDH1A1TSHR |
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-113302213-A | Catalyst for olefin polymerization and process for producing olefin polymer containing polar group | 国立大学法人东京大学 | 2021-08-24 | — | — | CN | disclosed |