Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.58 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.58 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.58 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.48 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.48 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.48 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.48 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.48 |
| ▸ | DHODH | Q02127 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | HPGD | P15428 | 4/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | RARB | P10826 | 2/20 | 0.40 |
| ▸ | RARG | P13631 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | RARA | P10276 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29171880 | 1.00 | TDP1 (0.58) | TDP1HSP90AA1ESR2GRIK1GRIA1 | |
| SCHEMBL30848087 | 0.89 | CHEK2 (0.46) | TDP1HSP90AA1ESR2ALDH1A1HPGD | |
| SCHEMBL29171929 | 0.89 | CHEK2 (0.46) | TDP1HSP90AA1ESR2ALDH1A1HPGD | |
| SCHEMBL30848233 | 0.86 | HSP90AA1 (0.42) | TDP1HSP90AA1ESR2GRIK1GRIA1 | |
| SCHEMBL29171874 | 0.84 | HSP90AA1 (0.54) | TDP1HSP90AA1ESR2GRIK1GRIA1 | |
| SCHEMBL30848167 | 0.84 | HSP90AA1 (0.54) | TDP1HSP90AA1ESR2GRIK1GRIA1 | |
| SCHEMBL1106071 | 0.83 | TDP1 (0.76) | TDP1HSP90AA1ESR2ALDH1A1HPGD | |
| SCHEMBL30848039 | 0.83 | TDP1 (0.53) | TDP1HSP90AA1ESR2GRIK1GRIA1 | |
| SCHEMBL30848269 | 0.83 | HSP90AA1 (0.53) | TDP1HSP90AA1ESR2GRIK1GRIA1 | |
| SCHEMBL29171981 | 0.83 | HSP90AA1 (0.53) | TDP1HSP90AA1ESR2GRIK1GRIA1 |
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-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 |
| WO-2024051354-A1 | BENZIMIDAZOLE COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 苏州沪云新药研发股份有限公司 | 2024-03-14 | — | — | WO | disclosed |