Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 2/20 | 0.58 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | CA1 | P00915 | 2/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | CA5A | P35218 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 5/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.48 |
| ▸ | HPGD | P15428 | 5/20 | 0.48 |
| ▸ | MAPT | P10636 | 5/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | PKM | P14618 | 2/20 | 0.48 |
| ▸ | ALOX12 | P18054 | 4/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL16230308 | 0.89 | KIF11 (0.71) | KIF11ABCG2ALDH1A1CA1CA2 | |
| SCHEMBL439543 | 0.88 | CA1 (0.60) | KIF11ABCG2ALDH1A1CA1CA2 | |
| SCHEMBL11029476 | 0.85 | ABCG2 (0.56) | ABCG2ALDH1A1MEN1KMT2AHPGD | |
| SCHEMBL16986581 | 0.84 | ALDH1A1 (0.67) | ALDH1A1CA1CA2RECQLHSD17B10 | |
| SCHEMBL6301913 | 0.83 | MEN1 (0.74) | ABCG2ALDH1A1CA1CA2CA9 | |
| SCHEMBL5430351 | 0.82 | CA1 (0.55) | KIF11ALDH1A1CA1CA2CA5A | |
| SCHEMBL11972898 | 0.80 | RAB9A (0.68) | ABCG2MEN1KMT2AMAPTHTT | |
| SCHEMBL13428706 | 0.80 | RAB9A (0.68) | ABCG2MEN1KMT2AMAPTHTT | |
| SCHEMBL4596394 | 0.80 | CA2 (0.66) | ALDH1A1CA1CA2CA9MEN1 | |
| SCHEMBL9217929 | 0.79 | EPHX2 (0.46) | KIF11CA1CA2CA9MAPT |
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-116354900-B | Chlorothiazole compound containing maleic acid structure, and preparation method and application thereof | 中国农业大学 | 2024-03-12 | — | — | CN | disclosed |
| CN-116354900-A | Chlorothiazole compound containing maleic acid structure, and preparation method and application thereof | 中国农业大学 | 2023-06-30 | — | — | CN | disclosed |