Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.57 |
| ▸ | PKM | P14618 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | HTT | P42858 | 1/20 | 0.57 |
| ▸ | CCR6 | P51684 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.57 |
| ▸ | GRIK1 | P39086 | 4/20 | 0.57 |
| ▸ | GRIK2 | Q13002 | 4/20 | 0.57 |
| ▸ | GRIK3 | Q13003 | 4/20 | 0.57 |
| ▸ | GRIK4 | Q16099 | 4/20 | 0.57 |
| ▸ | GRIK5 | Q16478 | 4/20 | 0.57 |
| ▸ | GRIA1 | P42261 | 2/20 | 0.57 |
| ▸ | GRIA2 | P42262 | 2/20 | 0.57 |
| ▸ | GRIA3 | P42263 | 2/20 | 0.57 |
| ▸ | GRIA4 | P48058 | 2/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9044798 | 0.79 | TSHR (0.56) | TDP1MAPTALDH1A1HTTNPSR1 | |
| SCHEMBL29721807 | 0.79 | TSHR (0.56) | TDP1MAPTALDH1A1HTTNPSR1 | |
| SCHEMBL29126950 | 0.79 | TSHR (0.56) | TDP1MAPTNPSR1GRIK1GRIK2 | |
| SCHEMBL30657595 | 0.79 | TSHR (0.56) | TDP1MAPTNPSR1GRIK1GRIK2 | |
| SCHEMBL30657597 | 0.78 | GRIK1 (0.57) | TDP1MAPTALDH1A1PKMGRIK1 | |
| SCHEMBL30657605 | 0.78 | GRIK1 (0.57) | TDP1MAPTALDH1A1GRIK1GRIK2 | |
| SCHEMBL11829870 | 0.78 | GRIK1 (0.57) | TDP1MAPTALDH1A1GRIK1GRIK2 | |
| SCHEMBL20816331 | 0.78 | GRIK1 (0.57) | TDP1MAPTALDH1A1PKMGRIK1 | |
| SCHEMBL772362 | 0.75 | TSHR (0.58) | TDP1MAPTALDH1A1HSP90AA1PKM | |
| SCHEMBL30313522 | 0.75 | TSHR (0.58) | TDP1MAPTALDH1A1HSP90AA1PKM |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117143104-A | Pyrrolo [1,2-a ] quinoxaline compound synthesized from nitropyrrole aromatic hydrocarbon and carbon dioxide and synthesis method thereof | 陕西科技大学 | 2023-12-01 | — | — | CN | disclosed |
| CN-115322200-B | Preparation method of spiro pyrroloquinoxaline derivative | 五邑大学 | 2023-09-19 | — | — | CN | disclosed |
| CN-115322200-A | Preparation method of spiro pyrroloquinoxaline derivative | 五邑大学 | 2022-11-11 | — | — | CN | disclosed |