Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | LCK | P06239 | 1/20 | 0.42 |
| ▸ | FYN | P06241 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA3 | P07451 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | CA6 | P23280 | 1/20 | 0.41 |
| ▸ | CA5A | P35218 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | RXRB | P28702 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2346964 | 0.87 | TDP1 (0.56) | TDP1LCKFYNCA12CA1 | |
| SCHEMBL3370087 | 0.82 | HSD17B10 (0.43) | TDP1LCKFYNCA12CA1 | |
| SCHEMBL17908058 | 0.81 | RXRB (0.57) | TDP1HSD17B10KDM4EALDH1A1HPGD | |
| SCHEMBL28434077 | 0.79 | ALDH1A1 (0.53) | TDP1CA12CA1CA2CA4 | |
| SCHEMBL422332 | 0.79 | ALDH1A1 (0.62) | HSD17B10KDM4EALDH1A1HPGDRXRB | |
| SCHEMBL14645907 | 0.78 | NR1H4 (0.51) | TDP1HSD17B10KDM4EALDH1A1HPGD | |
| SCHEMBL17908094 | 0.75 | ALDH1A1 (0.57) | TDP1LCKFYNCA12CA1 | |
| SCHEMBL21550254 | 0.73 | HPGD (0.42) | KDM4EALDH1A1HPGD | |
| SCHEMBL211284 | 0.72 | CSNK2A1 (0.55) | LCKFYNCA12CA1CA2 | |
| SCHEMBL29775265 | 0.72 | CSNK2A1 (0.55) | LCKFYNCA12CA1CA2 |
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-117720472-A | Benzimidazole compound, and preparation method and application thereof | 苏州沪云新药研发股份有限公司 | 2024-03-19 | — | — | CN | disclosed |