Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 7/20 | 0.37 |
| ▸ | ALPG | P10696 | 2/20 | 0.36 |
| ▸ | PLAA | Q9Y263 | 1/20 | 0.36 |
| ▸ | ALPL | P05186 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | CTSS | P25774 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL26129493 | 1.00 | ALDH1A1 (0.42) | ALDH1A1TLR7TSHRKCNH2ALPG | |
| SCHEMBL30645005 | 0.84 | TLR7 (0.39) | ALDH1A1TLR7KCNH2HDAC8HDAC6 | |
| SCHEMBL26124935 | 0.84 | TLR7 (0.39) | ALDH1A1TLR7KCNH2HDAC8HDAC6 | |
| SCHEMBL26127203 | 0.81 | CYP2D6 (0.46) | ALDH1A1TLR7TSHRKCNH2 | |
| SCHEMBL26130625 | 0.81 | KCNH2 (0.38) | TLR7KCNH2HDAC8HDAC6 | |
| SCHEMBL30645008 | 0.81 | KCNH2 (0.38) | TLR7KCNH2HDAC8HDAC6 | |
| SCHEMBL30613519 | 0.81 | CYP2D6 (0.46) | ALDH1A1TLR7TSHRKCNH2 | |
| SCHEMBL23121185 | 0.80 | KCNH2 (0.45) | ALDH1A1TSHRKCNH2ALPGPLAA | |
| SCHEMBL29437918 | 0.80 | KCNH2 (0.45) | ALDH1A1TSHRKCNH2ALPGPLAA | |
| SCHEMBL3273772 | 0.74 | MPO (0.39) | TLR7KCNH2 |
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-116891464-A | AT2R agonist | 武汉人福创新药物研发中心有限公司 | 2023-10-17 | — | — | CN | disclosed |